data_1h5o_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1h5o _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.7 tptp . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -76.72 -47.85 20.61 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.502 -0.749 . . . . 0.0 112.082 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -64.03 -40.27 95.96 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -172.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -66.95 -29.39 69.24 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -70.96 -48.78 51.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.763 -0.586 . . . . 0.0 112.549 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.88 -50.13 25.67 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.264 -0.898 . . . . 0.0 112.182 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.79 69.1 0.06 OUTLIER Glycine 0 N--CA 1.469 0.838 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.95 163.92 37.09 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.304 -176.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -137.49 144.03 42.02 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 92.9 m -78.77 133.57 37.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.151 0.977 . . . . 0.0 111.44 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -139.86 146.87 48.94 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.62 152.95 15.31 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.641 1.56 . . . . 0.0 112.527 171.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -23.61 60.98 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -89.45 -23.53 22.09 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -79.63 155.7 27.98 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.238 1.018 . . . . 0.0 111.583 -173.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.64 130.54 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 122.19 0.995 . . . . 0.0 112.049 -173.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.4 t -108.94 139.15 44.19 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 166.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.2 111.31 12.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.67 159.38 96.71 Favored 'Cis proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.957 7.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -86.04 -38.11 0.1 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 121.341 1.361 . . . . 0.0 114.904 -168.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.2 t -93.6 62.43 3.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.934 0.873 . . . . 0.0 111.859 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.6 p -162.53 98.27 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -150.39 141.86 23.42 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.781 1.277 . . . . 0.0 113.259 -170.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.496 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 62.5 m-85 -94.27 159.92 14.91 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.141 169.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.15 -124.95 2.52 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.378 -175.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.85 77.45 10.09 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.644 1.211 . . . . 0.0 110.281 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.655 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 96.4 mtp -73.42 -64.02 1.07 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.183 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.477 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 30.1 t70 -138.44 44.5 2.1 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.666 0.746 . . . . 0.0 109.367 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 86.5 m -153.35 -176.81 5.96 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.92 0.867 . . . . 0.0 110.76 -171.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -79.84 -177.68 6.06 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.245 1.021 . . . . 0.0 112.754 -170.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -60.89 -56.86 16.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -77.12 -4.41 44.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -175.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -108.58 153.01 23.98 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.166 -0.959 . . . . 0.0 109.334 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -140.19 153.56 46.65 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.641 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 35.7 m -91.07 124.22 35.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.246 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.0 t -79.15 155.88 28.49 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.304 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 121.501 0.667 . . . . 0.0 110.895 -169.704 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 98.2 mttt . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.408 ' OE1' ' SD ' ' A' ' 28' ' ' MET . 46.0 tt0 -76.67 -44.62 33.07 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.382 -0.824 . . . . 0.0 112.995 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.645 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -66.15 -38.6 88.52 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.797 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -63.31 -31.12 72.18 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -62.96 -44.17 96.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.838 -0.539 . . . . 0.0 112.156 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -70.65 -45.88 64.31 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.495 -0.753 . . . . 0.0 111.737 172.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.77 83.93 0.9 Allowed Glycine 0 N--CA 1.468 0.781 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.06 -166.58 24.26 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 119.577 -1.296 . . . . 0.0 112.222 -175.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -147.05 152.15 38.07 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.761 0.791 . . . . 0.0 108.986 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.1 m -79.8 123.99 28.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.054 -0.658 . . . . 0.0 110.177 175.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CD1' ' HB3' ' A' ' 37' ' ' CYS . 96.9 m-85 -126.35 148.36 63.6 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 175.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.13 156.66 19.7 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 121.592 1.528 . . . . 0.0 112.08 171.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -62.4 -31.16 71.8 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -99.25 -23.1 15.31 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -89.7 -161.22 0.76 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.529 -0.732 . . . . 0.0 111.75 -168.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.0 mt -79.1 139.19 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 122.707 1.242 . . . . 0.0 112.774 -169.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.2 t -116.02 144.48 44.05 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 166.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -141.65 110.58 6.23 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 119.461 -0.896 . . . . 0.0 108.866 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.99 154.4 87.81 Favored 'Cis proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.531 -1.445 . . . . 0.0 111.622 0.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -77.68 -33.53 2.27 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 121.273 1.315 . . . . 0.0 115.123 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.437 ' C ' ' HG ' ' A' ' 23' ' ' SER . 68.6 m -93.18 66.06 4.01 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.384 -0.823 . . . . 0.0 111.044 -174.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.495 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 55.4 m -163.74 74.64 0.33 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -101.33 141.85 33.59 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.548 1.166 . . . . 0.0 111.521 -172.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -117.59 152.45 35.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.031 175.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -76.03 -148.19 2.24 Favored Glycine 0 N--CA 1.47 0.967 0 C-N-CA 119.684 -1.246 . . . . 0.0 112.894 -173.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -81.11 95.29 6.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.815 1.293 . . . . 0.0 108.874 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.645 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 25.4 mmm -98.48 -74.52 0.58 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.844 -171.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -146.58 61.3 1.21 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 74.0 m -129.97 -103.0 0.3 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -149.27 -171.55 3.91 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.398 -0.814 . . . . 0.0 109.203 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -60.16 -55.98 27.22 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -171.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -94.41 10.83 32.84 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -109.85 164.74 12.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.445 1.117 . . . . 0.0 110.082 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -130.21 159.39 37.0 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.17 -176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 43.9 m -90.01 157.08 17.98 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.102 -1.039 . . . . 0.0 108.768 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 23' ' ' SER . 11.1 t -158.23 -178.83 7.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.894 0.854 . . . . 0.0 109.105 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 tptm . . . . . 0 C--N 1.325 -0.491 0 CA-C-O 121.829 0.823 . . . . 0.0 110.227 -174.352 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.1 tptm . . . . . 0 N--CA 1.47 0.537 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -79.0 -55.51 5.07 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.725 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 77.8 m -62.98 -29.11 70.56 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.06 -29.55 67.7 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.303 -0.873 . . . . 0.0 112.494 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -58.7 -50.77 72.65 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.653 -0.655 . . . . 0.0 111.46 173.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.0 -47.11 81.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.303 172.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 103.61 55.84 0.78 Allowed Glycine 0 N--CA 1.468 0.791 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.466 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.69 -152.29 7.69 Favored Glycine 0 N--CA 1.468 0.803 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -150.47 148.72 29.07 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.17 0.986 . . . . 0.0 109.992 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.5 t -80.92 113.81 19.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.785 0.802 . . . . 0.0 110.786 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -124.73 157.65 65.18 Favored Pre-proline 0 N--CA 1.471 0.579 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.556 178.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -58.77 157.88 26.5 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.849 1.7 . . . . 0.0 113.793 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -63.27 -27.85 69.62 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.91 -30.37 58.75 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -74.48 154.48 38.69 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.228 1.013 . . . . 0.0 111.197 -171.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.0 mt -79.47 124.48 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 122.022 0.915 . . . . 0.0 111.077 -169.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 49.4 t -95.49 140.51 30.24 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 169.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.21 119.31 29.67 Favored Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.03 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 166.77 82.06 Favored 'Cis proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.402 -1.499 . . . . 0.0 111.419 1.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -51.36 -49.81 15.95 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 122.098 1.865 . . . . 0.0 115.464 -172.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.9 p -92.58 56.73 2.77 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.638 0.732 . . . . 0.0 111.818 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.8 m -145.34 69.89 1.25 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 122.426 1.108 . . . . 0.0 109.574 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.428 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 5.1 p30 -144.27 151.42 39.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.083 0.944 . . . . 0.0 109.12 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.63 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 36.1 m-85 -98.04 170.2 9.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.608 0.718 . . . . 0.0 109.07 175.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.08 -142.82 3.47 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.673 -1.251 . . . . 0.0 112.441 -171.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -79.16 81.98 5.37 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.782 1.277 . . . . 0.0 109.57 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.725 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 95.1 mtp -82.17 -111.02 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.466 -178.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -91.24 64.13 5.14 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 t -142.64 169.71 17.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -169.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 51.0 ttt85 -67.75 166.44 15.31 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.321 -0.862 . . . . 0.0 110.753 -177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -51.29 -46.84 62.62 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -108.88 28.23 8.67 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.238 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -111.51 168.91 9.18 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.301 -0.874 . . . . 0.0 109.347 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -135.46 149.1 49.47 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.484 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.7 m -89.48 114.91 26.48 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.803 0.811 . . . . 0.0 109.56 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 50.0 t -84.98 126.77 33.8 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.944 0.878 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 57.0 tptt . . . . . 0 C--N 1.324 -0.501 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -176.887 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 122.412 1.101 . . . . 0.0 113.139 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -68.75 -52.22 32.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.175 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.0 t -68.21 -29.54 68.41 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.351 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -68.76 -30.14 68.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.908 174.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -67.01 -36.24 81.7 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -82.47 -53.32 6.08 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.004 174.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.64 81.83 0.14 Allowed Glycine 0 N--CA 1.467 0.708 0 C-N-CA 119.992 -1.099 . . . . 0.0 110.582 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.75 170.33 40.5 Favored Glycine 0 N--CA 1.468 0.773 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.98 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -132.03 155.02 48.76 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.2 m -81.29 136.57 35.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.814 0.816 . . . . 0.0 112.282 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -134.1 149.63 72.02 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.05 173.49 0.9 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 121.885 1.724 . . . . 0.0 114.019 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.25 -48.9 16.3 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.524 -0.735 . . . . 0.0 111.487 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -29.88 70.95 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -86.42 137.52 32.49 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.727 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.4 mt -100.5 133.55 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 CA-C-O 121.795 0.807 . . . . 0.0 110.813 -170.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 p -102.39 149.51 24.29 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.4 tp -117.61 131.06 24.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -174.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.7 160.54 90.67 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.207 1.467 . . . . 0.0 113.363 5.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -85.19 -30.6 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 121.254 1.303 . . . . 0.0 113.996 -169.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.5 m -93.45 52.62 1.76 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.312 -0.868 . . . . 0.0 110.771 178.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -150.23 77.88 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.65 0.738 . . . . 0.0 109.193 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -157.95 158.9 35.85 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.311 1.053 . . . . 0.0 111.245 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.446 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 57.7 m-85 -99.66 170.04 8.85 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.342 -0.845 . . . . 0.0 109.645 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.09 -133.76 4.39 Favored Glycine 0 N--CA 1.47 0.902 0 C-N-CA 119.806 -1.188 . . . . 0.0 112.907 -170.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -84.92 86.88 7.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.16 0.981 . . . . 0.0 108.471 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.446 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 74.1 mtp -84.5 -76.26 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.894 -171.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -128.72 12.02 6.26 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 79.9 m -114.1 -157.78 0.64 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.62 -0.675 . . . . 0.0 109.578 178.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -78.88 -178.87 6.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.377 1.084 . . . . 0.0 111.92 -171.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -63.51 -49.06 75.02 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -176.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -91.22 18.54 6.84 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -113.84 156.17 24.4 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -135.17 157.2 47.52 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.081 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.5 t -98.39 107.93 20.51 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.808 -176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.0 t -97.33 148.64 22.93 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.284 1.04 . . . . 0.0 111.571 -172.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.2 tttp . . . . . 0 N--CA 1.467 0.396 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.909 176.66 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 51.5 tptt . . . . . 0 N--CA 1.469 0.494 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.19 -49.88 14.19 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.342 -173.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.6 t -77.36 -28.65 53.0 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -70.77 -33.84 71.18 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.135 -0.978 . . . . 0.0 112.832 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -76.91 -39.36 51.13 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.726 -0.609 . . . . 0.0 111.629 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -71.75 -35.63 70.17 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.498 -0.751 . . . . 0.0 112.299 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.22 90.66 2.0 Favored Glycine 0 N--CA 1.47 0.934 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.824 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.1 146.25 9.78 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 119.52 -1.324 . . . . 0.0 112.324 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -101.57 143.8 31.11 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' SG ' ' HE3' ' A' ' 34' ' ' TRP . 42.3 t -85.54 131.32 34.39 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.361 -0.837 . . . . 0.0 111.864 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -132.73 154.08 81.32 Favored Pre-proline 0 N--CA 1.471 0.62 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.79 163.47 15.91 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.836 1.69 . . . . 0.0 111.599 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.67 -4.62 16.3 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.33 -21.16 42.78 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -87.16 152.26 22.48 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.028 0.918 . . . . 0.0 112.57 -169.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -83.2 135.92 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 121.822 0.82 . . . . 0.0 109.05 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -96.09 119.16 34.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.726 0.774 . . . . 0.0 110.509 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.7 tp -121.35 134.36 24.47 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.88 168.33 76.85 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 123.676 -1.385 . . . . 0.0 111.72 2.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -58.53 -51.07 7.97 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.606 1.537 . . . . 0.0 114.777 -170.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.485 ' C ' ' HG ' ' A' ' 23' ' ' SER . 70.5 m -90.5 58.91 4.12 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.616 0.722 . . . . 0.0 111.468 -177.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.485 ' HG ' ' C ' ' A' ' 22' ' ' SER . 67.9 m -162.48 83.2 0.54 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.14 0.971 . . . . 0.0 108.672 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -157.33 160.8 38.87 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.61 0.719 . . . . 0.0 109.104 -171.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.9 m-85 -135.54 163.96 28.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.816 0.817 . . . . 0.0 110.14 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.05 -143.31 5.65 Favored Glycine 0 N--CA 1.47 0.911 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.093 -176.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -77.68 98.4 5.46 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.317 1.055 . . . . 0.0 109.016 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.554 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 85.2 mtp -90.19 -113.63 0.07 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.584 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -110.62 68.64 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.8 t -142.26 -88.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -141.47 155.37 45.84 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -55.85 -34.15 65.17 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -109.49 15.34 23.04 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.421 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 33.0 m0 -113.4 161.57 17.14 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.058 -1.026 . . . . 0.0 109.505 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -113.42 170.95 7.87 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.362 0.601 . . . . 0.0 110.364 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.516 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.9 t -119.92 97.15 5.47 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.443 -0.785 . . . . 0.0 109.174 173.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.3 t -86.12 150.54 24.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.768 0.794 . . . . 0.0 111.545 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt . . . . . 0 N--CA 1.466 0.362 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.7 179.993 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt . . . . . 0 N--CA 1.468 0.455 0 CA-C-O 120.643 0.259 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -77.38 -47.89 18.7 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.563 -0.71 . . . . 0.0 112.47 -174.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.7 t -62.99 -30.29 71.48 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -76.96 -38.09 53.94 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.459 -0.776 . . . . 0.0 112.092 174.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -69.82 -42.48 73.6 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.593 -0.692 . . . . 0.0 112.504 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -71.69 -63.02 1.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.316 -0.865 . . . . 0.0 111.235 177.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.84 83.7 0.05 OUTLIER Glycine 0 N--CA 1.467 0.723 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.627 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.19 163.76 37.43 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.664 -1.255 . . . . 0.0 111.242 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -123.78 147.28 47.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.6 m -78.47 125.28 29.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.755 0.788 . . . . 0.0 110.716 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -132.98 156.56 79.95 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.8 136.72 77.97 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.898 1.732 . . . . 0.0 112.294 175.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -76.87 -29.59 55.87 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -172.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.13 -28.26 69.94 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 172.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -81.52 144.76 31.09 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.096 0.95 . . . . 0.0 109.279 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -87.71 133.92 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.864 0.84 . . . . 0.0 111.203 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 57.7 m -74.67 131.08 40.59 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 168.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.51 116.58 31.94 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.79 163.49 85.88 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.482 -1.466 . . . . 0.0 112.56 7.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -72.01 -27.06 17.75 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.892 1.728 . . . . 0.0 113.834 -175.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.3 p -71.1 -28.92 64.66 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.51 -0.744 . . . . 0.0 112.804 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -84.46 81.9 8.64 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.483 -0.761 . . . . 0.0 109.395 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -150.29 130.38 13.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 122.575 1.179 . . . . 0.0 111.058 -173.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.615 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 26.9 m-85 -106.4 152.24 23.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.327 173.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.56 -133.92 3.67 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.914 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -80.52 83.89 6.23 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.754 1.264 . . . . 0.0 110.213 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.615 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 94.1 mtp -81.17 -69.1 0.63 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.857 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -151.72 57.65 0.86 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 84.9 m -123.32 -105.36 0.36 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -155.17 -169.21 3.1 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.349 -0.844 . . . . 0.0 109.114 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 45.7 t-105 -60.99 -51.76 67.88 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.31 -0.869 . . . . 0.0 112.987 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -85.58 -0.07 53.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -120.23 150.92 39.91 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.803 1.183 . . . . 0.0 109.767 -177.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -134.21 177.21 7.92 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.132 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -103.46 136.76 42.6 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.076 -1.015 . . . . 0.0 110.951 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 79.6 m -84.49 142.05 30.33 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt . . . . . 0 N--CA 1.469 0.487 0 CA-C-O 122.019 0.914 . . . . 0.0 110.391 -176.009 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -78.49 -44.5 24.32 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.39 -40.75 95.49 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -71.32 -36.43 71.58 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.635 -0.666 . . . . 0.0 112.213 176.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -67.64 -38.04 83.29 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -72.39 -51.75 19.04 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.178 -0.952 . . . . 0.0 111.629 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.58 72.91 0.03 OUTLIER Glycine 0 N--CA 1.467 0.752 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.113 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.52 -174.16 42.76 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 119.522 -1.323 . . . . 0.0 112.24 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -143.82 153.06 41.98 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.03 119.12 21.71 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.986 0.898 . . . . 0.0 110.773 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.89 152.38 75.24 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -60.03 168.93 5.3 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 121.49 1.46 . . . . 0.0 113.882 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -58.73 -51.39 70.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.373 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.0 -26.97 69.1 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.05 134.33 42.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 122.162 0.982 . . . . 0.0 109.969 176.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.1 mt -85.19 132.24 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-O 121.821 0.82 . . . . 0.0 111.356 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 94.0 m -78.23 136.52 37.8 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.8 117.93 30.84 Favored Pre-proline 0 N--CA 1.469 0.505 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -80.32 166.24 76.48 Favored 'Cis proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.269 -1.555 . . . . 0.0 112.846 8.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -59.35 -39.49 76.68 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 121.922 1.748 . . . . 0.0 115.102 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -90.06 59.43 4.5 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.976 0.893 . . . . 0.0 110.823 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.3 t -161.27 85.75 0.67 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.444 ' OD1' ' SG ' ' A' ' 18' ' ' CYS . 27.8 t70 -157.23 126.68 6.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.743 -0.783 . . . . 0.0 109.572 -169.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -83.12 154.03 24.53 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.77 -129.87 1.16 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 119.68 -1.248 . . . . 0.0 112.092 -174.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HB2' ' HZ3' ' A' ' 27' ' ' LYS . 10.5 mtmp? -84.23 94.97 8.53 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.784 0.802 . . . . 0.0 108.981 177.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 40.9 mmm -89.5 -77.52 0.38 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.994 -172.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -145.86 43.85 1.26 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.777 0.799 . . . . 0.0 111.454 -176.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 88.5 m -134.11 -151.21 0.43 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -83.04 -178.61 7.18 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.622 -1.299 . . . . 0.0 111.567 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.1 t-105 -57.95 -54.09 50.91 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -92.98 25.26 3.28 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -114.16 154.89 27.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 122.394 1.092 . . . . 0.0 110.012 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -120.29 164.1 16.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.965 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.6 t -110.85 112.19 23.87 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 169.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -78.62 143.8 36.06 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.238 -173.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.929 174.74 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -78.19 -49.48 13.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.3 t -68.0 -33.66 75.04 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.439 -0.904 . . . . 0.0 113.199 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.06 -30.51 70.59 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.028 -0.669 . . . . 0.0 112.751 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -66.4 -44.34 83.28 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.908 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.58 -50.43 11.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.748 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.25 92.27 0.44 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 120.022 -1.085 . . . . 0.0 110.85 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.99 172.13 42.11 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.954 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -130.87 143.31 50.64 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 m -78.16 128.56 33.97 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.343 1.068 . . . . 0.0 110.967 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -132.14 147.35 65.45 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.441 ' HA ' ' CD1' ' A' ' 34' ' ' TRP . 52.8 Cg_exo -56.98 149.2 63.43 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 121.411 1.407 . . . . 0.0 112.213 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.93 -29.43 69.61 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -64.31 -25.06 67.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -79.06 150.48 31.86 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.481 -0.762 . . . . 0.0 110.374 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -78.42 113.42 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 122.055 0.931 . . . . 0.0 110.643 -173.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 42.5 t -85.43 124.49 32.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 169.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -125.81 116.57 24.39 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.42 163.7 89.69 Favored 'Cis proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.44 -1.483 . . . . 0.0 112.019 5.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.62 -29.82 60.65 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.97 1.78 . . . . 0.0 114.25 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 93.1 p -96.93 50.46 1.1 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.576 -0.703 . . . . 0.0 111.803 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 92.1 p -152.11 78.53 1.23 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.371 1.082 . . . . 0.0 109.626 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.4 p30 -156.84 158.14 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 122.192 0.996 . . . . 0.0 108.827 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.454 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 88.3 m-85 -91.53 174.01 7.59 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 170.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -137.73 5.69 Favored Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.313 -1.422 . . . . 0.0 111.09 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -79.48 97.98 6.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.942 0.877 . . . . 0.0 108.874 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.454 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 61.2 mtp -89.34 -121.4 0.05 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.114 -172.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.54 48.51 1.15 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.369 -0.832 . . . . 0.0 110.808 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 99.8 m -131.53 -93.39 0.39 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -157.54 -176.1 5.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.824 -1.173 . . . . 0.0 112.482 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -60.39 -55.46 33.25 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -90.55 23.36 3.05 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -175.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.441 ' CD1' ' HA ' ' A' ' 13' ' ' PRO . 34.9 m0 -119.93 142.75 48.45 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.099 -1.001 . . . . 0.0 109.474 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -113.88 157.96 21.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.683 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.422 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 4.3 t -100.51 107.13 18.75 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.955 174.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 46.4 t -81.5 142.81 32.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 122.143 0.973 . . . . 0.0 111.095 -172.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt . . . . . 0 C--N 1.326 -0.435 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 N--CA 1.47 0.55 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -78.4 -51.65 9.73 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -171.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.6 t -65.97 -29.96 70.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -76.03 -32.46 59.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.489 -0.757 . . . . 0.0 112.567 175.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -68.39 -45.35 72.93 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.83 -0.544 . . . . 0.0 112.065 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -78.54 -28.44 46.1 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.638 -0.663 . . . . 0.0 112.579 176.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.99 60.83 0.71 Allowed Glycine 0 N--CA 1.468 0.822 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.372 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.6 157.07 17.99 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -107.51 140.01 41.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.11 129.96 35.0 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.631 0.729 . . . . 0.0 111.096 -177.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -141.55 159.83 58.94 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -63.32 144.14 90.66 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 121.736 1.624 . . . . 0.0 112.737 176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -73.9 -55.09 6.6 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.468 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.15 -30.51 70.43 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -92.67 169.66 10.33 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 122.14 0.971 . . . . 0.0 109.968 174.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.6 mt -74.67 124.67 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 121.518 -0.739 . . . . 0.0 111.187 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -100.15 144.44 29.17 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 169.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -119.33 117.82 32.88 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.72 162.65 74.78 Favored 'Cis proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.641 9.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -88.34 -55.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 121.128 1.219 . . . . 0.0 113.398 -169.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 97.3 p -85.6 48.9 1.66 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.601 -0.687 . . . . 0.0 112.574 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 79.0 p -167.81 72.51 0.11 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.434 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 4.6 p30 -134.87 153.7 51.95 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.9 1.333 . . . . 0.0 112.513 -169.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.515 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 73.3 m-85 -94.7 164.31 13.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.938 173.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.29 -138.85 5.76 Favored Glycine 0 N--CA 1.468 0.832 0 C-N-CA 119.987 -1.101 . . . . 0.0 112.029 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -82.22 90.09 6.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.962 0.887 . . . . 0.0 108.892 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.515 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 88.6 mtp -86.01 -86.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -175.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -140.72 50.6 1.66 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 122.052 0.93 . . . . 0.0 109.223 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 85.9 m -98.98 -90.92 0.29 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -150.21 -179.88 7.54 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -57.99 -54.85 42.22 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.826 -1.171 . . . . 0.0 113.332 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -94.96 11.78 30.68 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -105.94 162.84 13.23 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 120.364 -1.46 . . . . 0.0 111.209 -174.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 61.2 pttt -144.12 171.87 13.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.164 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.3 m -104.1 145.93 29.47 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.099 -1.0 . . . . 0.0 110.587 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -130.47 155.68 46.05 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.475 -0.766 . . . . 0.0 109.999 173.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.3 -174.286 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.662 0.268 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.31 -48.33 15.9 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -171.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.31 -39.65 89.46 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -70.54 -37.18 74.03 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -67.73 -43.6 79.58 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.444 -0.785 . . . . 0.0 112.585 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.99 -50.59 40.03 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.951 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.79 72.56 0.07 OUTLIER Glycine 0 N--CA 1.467 0.748 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.933 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.98 152.52 17.48 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 119.533 -1.317 . . . . 0.0 111.484 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -109.23 152.16 25.55 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.751 0.786 . . . . 0.0 109.577 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -79.87 126.18 30.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.17 0.986 . . . . 0.0 111.539 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -130.59 146.56 62.36 Favored Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.22 172.62 2.37 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 121.587 1.525 . . . . 0.0 113.106 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -68.2 -41.25 81.65 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -75.88 -25.49 56.17 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -70.24 138.9 52.06 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 122.084 0.945 . . . . 0.0 110.091 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.8 mt -78.82 120.98 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 122.143 0.973 . . . . 0.0 110.642 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.5 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 43.5 t -85.65 126.3 33.82 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 169.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.27 116.5 30.94 Favored Pre-proline 0 N--CA 1.469 0.496 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -172.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.46 162.44 90.51 Favored 'Cis proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.464 5.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -70.14 -32.05 17.73 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.929 1.752 . . . . 0.0 114.132 -172.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.455 ' C ' ' HG ' ' A' ' 23' ' ' SER . 68.4 m -91.63 60.2 3.96 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.017 175.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.455 ' HG ' ' C ' ' A' ' 22' ' ' SER . 50.5 m -165.99 71.01 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.968 0.89 . . . . 0.0 109.206 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.5 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 3.3 p30 -154.56 151.61 29.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.837 0.827 . . . . 0.0 108.968 178.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -93.02 174.19 7.36 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.601 -0.84 . . . . 0.0 108.901 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.24 -134.79 3.77 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 119.748 -1.215 . . . . 0.0 110.936 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.65 123.76 25.45 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 78.8 mmm -117.98 -95.39 0.48 Allowed 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.249 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -130.55 54.66 1.87 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 122.058 0.932 . . . . 0.0 109.852 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.6 m -144.85 -77.8 0.2 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.161 -0.615 . . . . 0.0 109.62 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -145.46 164.35 31.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.735 0.779 . . . . 0.0 109.539 -173.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -61.62 -49.37 76.85 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -102.31 30.57 4.47 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -114.24 154.37 28.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.121 -0.987 . . . . 0.0 109.051 175.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -114.93 160.57 19.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.913 0.863 . . . . 0.0 111.58 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.72 103.78 13.14 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 44.4 t -79.66 148.61 31.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 122.211 1.005 . . . . 0.0 111.282 -172.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 121.787 0.803 . . . . 0.0 109.665 -175.839 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 tptp . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.568 0.223 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -78.77 -50.19 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -175.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.85 -36.03 81.92 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -75.94 -32.69 59.67 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 112.693 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -66.26 -42.36 88.64 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.73 -0.606 . . . . 0.0 112.072 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -69.33 -48.35 61.67 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.579 -0.849 . . . . 0.0 110.66 171.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.72 92.88 1.41 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -174.52 170.31 43.4 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 118.912 -1.613 . . . . 0.0 112.709 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -131.0 153.63 49.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 99.2 m -79.42 120.49 23.9 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 122.069 0.937 . . . . 0.0 110.992 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -116.81 154.28 49.44 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 171.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -60.97 172.55 2.91 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 121.393 1.395 . . . . 0.0 113.94 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -62.39 -44.78 95.63 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.84 -27.28 69.06 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -174.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -75.55 141.17 43.02 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.295 1.045 . . . . 0.0 111.26 -170.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.1 mt -81.51 133.46 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 121.948 0.88 . . . . 0.0 109.611 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 23' ' ' SER . 35.4 t -84.56 133.07 34.45 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.62 115.17 13.45 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -176.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -74.47 164.33 88.23 Favored 'Cis proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.309 -1.538 . . . . 0.0 111.947 4.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.51 -13.95 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 121.767 1.644 . . . . 0.0 114.48 -171.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 48.2 m -71.22 -24.0 62.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 177.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 69.0 m -100.42 50.02 0.9 Allowed 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.673 -0.642 . . . . 0.0 111.574 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -101.94 100.13 10.39 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.555 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 24.8 m-85 -99.28 159.6 14.88 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.571 -174.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.15 -144.94 2.48 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 119.717 -1.23 . . . . 0.0 112.121 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -82.2 74.72 9.16 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.449 1.119 . . . . 0.0 110.577 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.555 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 95.6 mtp -71.18 -79.61 0.07 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.505 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.05 52.95 0.72 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 169.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.2 m -132.52 173.39 11.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.802 0.811 . . . . 0.0 109.946 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -79.96 -165.78 0.89 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.4 t-105 -52.48 -64.27 0.87 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -101.51 16.58 25.23 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -98.09 160.16 14.48 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.532 -1.355 . . . . 0.0 110.821 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -124.76 141.31 52.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.641 -169.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.35 122.42 30.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.9 t -128.35 144.58 51.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.618 0.723 . . . . 0.0 110.159 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp . . . . . 0 N--CA 1.468 0.427 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.513 176.196 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.42 -46.99 18.51 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.995 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.1 t -72.14 -29.15 63.77 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -64.99 -29.14 70.04 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.274 -0.891 . . . . 0.0 112.49 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -55.71 -45.26 77.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.432 -0.507 . . . . 0.0 111.937 173.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -76.88 -45.23 28.94 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.545 -0.722 . . . . 0.0 111.184 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.91 64.94 0.29 Allowed Glycine 0 N--CA 1.469 0.894 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.336 173.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.46 158.44 28.97 Favored Glycine 0 N--CA 1.467 0.761 0 C-N-CA 119.613 -1.279 . . . . 0.0 111.745 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -102.77 158.97 15.88 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.629 0.728 . . . . 0.0 109.759 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.0 m -79.34 138.58 37.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.106 0.955 . . . . 0.0 110.858 177.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.92 159.09 72.46 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -59.24 141.68 98.19 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.78 1.653 . . . . 0.0 113.237 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -72.06 -45.0 62.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.061 -0.655 . . . . 0.0 112.49 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.35 -28.78 67.15 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -174.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -94.36 158.64 15.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.196 0.998 . . . . 0.0 110.349 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.0 mt -83.89 132.67 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-O 121.817 0.817 . . . . 0.0 110.437 -172.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.34 137.57 32.21 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 169.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -115.44 118.57 39.35 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -84.39 161.66 67.75 Favored 'Cis proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.425 -1.489 . . . . 0.0 112.49 8.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -66.63 -39.46 15.76 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.617 1.545 . . . . 0.0 114.391 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 56.0 m -67.62 -36.92 81.74 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 m -85.05 78.63 9.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.76 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -143.09 150.83 40.03 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.414 1.102 . . . . 0.0 110.187 -171.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.616 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 32.5 m-85 -125.95 154.94 42.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.35 -175.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.31 -138.69 4.55 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.285 -172.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.92 85.5 6.21 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 122.018 0.913 . . . . 0.0 109.098 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.616 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 82.7 mtp -84.88 -108.66 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -177.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -108.23 66.8 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 171.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 90.2 m -129.06 -175.65 3.62 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.19 0.995 . . . . 0.0 111.015 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -77.96 170.59 16.34 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.676 0.751 . . . . 0.0 110.669 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -53.53 -55.53 24.75 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 33' ' ' ARG . 38.8 mtm105 -94.52 22.93 5.66 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.577 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -116.96 159.6 22.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.535 1.159 . . . . 0.0 109.353 178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -133.85 173.05 11.96 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.776 176.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 25' ' ' PHE . 5.8 t -99.69 155.02 17.84 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.912 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -148.56 150.93 34.2 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.541 -0.864 . . . . 0.0 109.536 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.3 tttt . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 121.916 0.865 . . . . 0.0 110.089 -179.561 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 120.676 0.274 . . . . 0.0 111.011 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -76.15 -38.75 56.35 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.431 -0.793 . . . . 0.0 112.14 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.4 t -55.41 -37.53 67.76 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -72.18 -39.09 68.93 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.723 -0.611 . . . . 0.0 112.279 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -66.27 -41.35 90.0 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.827 -0.546 . . . . 0.0 112.398 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -66.01 -38.55 88.74 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.423 -0.798 . . . . 0.0 111.656 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.16 83.84 1.7 Allowed Glycine 0 N--CA 1.467 0.734 0 C-N-CA 120.267 -0.968 . . . . 0.0 111.458 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.78 148.31 10.02 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.307 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -83.46 154.82 23.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.596 0.712 . . . . 0.0 109.183 175.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 37.2 m -78.76 125.3 29.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.724 -0.79 . . . . 0.0 110.133 177.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -128.98 148.34 68.56 Favored Pre-proline 0 N--CA 1.468 0.475 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.633 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -56.95 166.9 3.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.934 1.756 . . . . 0.0 113.55 173.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -61.67 -37.83 85.53 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.54 -20.13 66.21 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -176.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -75.69 124.46 27.28 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.381 -0.824 . . . . 0.0 111.106 -175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.3 mt -74.28 137.09 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.091 0.948 . . . . 0.0 109.638 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 33.5 t -88.56 123.95 33.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.0 tp -134.11 125.24 17.91 Favored Pre-proline 0 CA--C 1.538 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -70.46 167.14 73.97 Favored 'Cis proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.048 -1.647 . . . . 0.0 114.165 7.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -66.97 -30.13 39.84 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.702 1.601 . . . . 0.0 114.711 -171.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.6 m -69.35 -43.19 74.12 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -172.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -90.02 73.28 7.35 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.51 -0.744 . . . . 0.0 111.652 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -123.19 132.66 54.14 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -117.85 148.56 42.0 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.37 0.605 . . . . 0.0 109.45 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.64 -124.74 2.04 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.882 -175.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.97 113.12 16.83 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.3 mmm -117.91 -93.18 0.52 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -171.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -138.07 59.95 1.64 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 75.1 m -123.28 -88.93 0.61 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -179.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -159.54 -168.85 2.4 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 62.0 t-105 -61.95 -50.64 71.31 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -173.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -102.13 21.28 15.15 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -118.35 164.39 15.29 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 122.601 1.191 . . . . 0.0 110.304 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -132.81 178.8 6.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.702 -178.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 12.8 m -118.27 145.22 45.21 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.917 0.865 . . . . 0.0 109.752 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.8 t -141.89 141.36 33.02 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.904 0.859 . . . . 0.0 109.784 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 tttm . . . . . 0 N--CA 1.468 0.453 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.277 175.931 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -76.93 -49.02 16.52 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.734 -0.786 . . . . 0.0 112.533 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.9 t -75.13 -31.02 60.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.344 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -68.88 -29.1 67.32 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.366 -0.834 . . . . 0.0 111.958 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -61.61 -39.86 92.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.494 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -75.13 -45.53 40.4 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.38 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.89 91.14 1.37 Allowed Glycine 0 N--CA 1.466 0.639 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.34 -176.24 39.14 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 118.845 -1.645 . . . . 0.0 112.91 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -138.91 145.29 39.68 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.7 m -90.86 143.8 26.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.642 1.21 . . . . 0.0 112.232 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -141.47 158.82 62.63 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.374 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.54 164.13 3.25 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.821 1.681 . . . . 0.0 113.493 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.17 -22.57 62.95 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.57 -24.45 39.19 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -176.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -74.43 142.92 44.92 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.98 0.895 . . . . 0.0 110.821 -176.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.8 mt -82.0 131.81 32.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.92 0.867 . . . . 0.0 109.676 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 95.8 m -98.33 102.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 169.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.5 tp -110.38 133.61 21.05 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 163.31 86.11 Favored 'Cis proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.383 5.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -69.92 -24.33 29.07 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.645 1.563 . . . . 0.0 113.599 -171.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p -87.62 49.44 1.81 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 122.056 0.932 . . . . 0.0 110.49 174.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 t -150.91 51.4 0.86 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' SG ' ' A' ' 37' ' ' CYS . 32.3 t70 -140.64 129.19 22.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.652 0.739 . . . . 0.0 109.291 -171.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -116.21 162.12 17.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.9 -145.56 5.9 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 119.231 -1.461 . . . . 0.0 111.546 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -78.81 101.72 7.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.268 1.032 . . . . 0.0 108.952 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.439 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 90.9 mtp -96.92 -118.81 0.12 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -96.81 62.77 1.93 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.0 0.905 . . . . 0.0 108.719 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 50.3 m -146.92 -160.97 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.519 0.676 . . . . 0.0 110.301 -174.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -71.21 157.17 38.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.185 0.993 . . . . 0.0 110.913 -174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -56.79 -50.22 72.99 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.68 12.1 31.02 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.858 -177.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -108.82 172.0 7.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.378 -0.826 . . . . 0.0 108.868 175.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -139.59 173.82 11.14 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.626 -0.829 . . . . 0.0 110.591 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.439 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.8 t -109.44 153.08 24.53 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.557 -177.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 89.2 m -139.43 157.79 45.25 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.997 -179.814 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.3 tptm . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -74.11 -60.59 2.19 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.636 -0.826 . . . . 0.0 112.372 -170.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.4 ' HB2' ' CB ' ' A' ' 28' ' ' MET . 4.6 t -78.37 -36.3 46.21 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.994 -1.066 . . . . 0.0 112.318 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -65.82 -37.37 86.07 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.061 -0.656 . . . . 0.0 112.404 -174.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -78.96 -29.82 44.17 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.065 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -79.36 -59.68 2.66 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.258 -0.902 . . . . 0.0 110.254 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.09 90.6 0.15 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 119.724 -1.227 . . . . 0.0 111.245 176.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.69 -177.13 40.5 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 119.017 -1.563 . . . . 0.0 112.68 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -138.17 150.35 46.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m -82.1 136.95 35.11 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 122.117 0.96 . . . . 0.0 112.354 -176.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -139.04 147.34 53.31 Favored Pre-proline 0 N--CA 1.467 0.398 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.9 148.21 48.01 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 121.729 1.619 . . . . 0.0 112.338 173.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -70.48 -45.05 66.45 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.553 -174.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.19 -33.58 74.81 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.31 147.89 29.66 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.974 0.893 . . . . 0.0 109.835 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -86.78 133.79 29.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.221 1.01 . . . . 0.0 111.303 -169.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.9 m -77.61 133.68 38.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.353 170.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.26 113.95 13.5 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -176.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.89 159.09 80.23 Favored 'Cis proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.184 -1.59 . . . . 0.0 112.627 10.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -93.9 48.52 0.31 Allowed 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 121.58 1.52 . . . . 0.0 111.123 -173.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -74.62 -41.35 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.172 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -149.3 120.13 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.625 -0.83 . . . . 0.0 109.864 -173.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -114.85 104.51 12.02 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.89 0.852 . . . . 0.0 109.536 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.701 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 63.6 m-85 -79.2 162.94 25.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.065 0.936 . . . . 0.0 110.354 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.2 -126.99 5.27 Favored Glycine 0 N--CA 1.465 0.602 0 C-N-CA 119.64 -1.267 . . . . 0.0 111.741 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -82.12 96.82 7.91 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.004 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.701 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 71.2 mtp -108.36 -116.01 0.28 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -177.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.437 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 60.8 m-20 -91.11 53.51 2.37 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.129 169.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.5 m -135.55 171.98 13.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.998 0.904 . . . . 0.0 110.78 -173.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -64.56 166.14 9.0 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.654 0.74 . . . . 0.0 110.541 179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.5 t-105 -55.17 -51.96 64.85 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -174.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -96.03 24.29 5.69 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.463 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -111.23 -174.37 2.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 122.115 0.96 . . . . 0.0 108.811 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -150.2 166.99 28.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.24 -172.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.584 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 1.8 t -111.47 140.53 45.99 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.194 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.5 m -121.11 152.46 38.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.16 0.981 . . . . 0.0 110.588 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 115.31 -0.859 . . . . 0.0 108.831 -177.33 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.0 tptm . . . . . 0 N--CA 1.467 0.379 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.56 -59.97 2.56 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.252 -170.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.501 ' H ' ' HB2' ' A' ' 29' ' ' ASP . 14.1 t -77.37 -30.75 53.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.968 -172.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.41 -34.87 78.67 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.594 -0.691 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -70.25 -41.04 74.03 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.762 177.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -74.79 -57.86 3.65 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.992 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.53 84.67 0.07 OUTLIER Glycine 0 N--CA 1.465 0.595 0 C-N-CA 119.837 -1.173 . . . . 0.0 110.466 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.67 169.21 39.06 Favored Glycine 0 CA--C 1.525 0.694 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.542 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -128.56 128.11 43.63 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 36' ' ' CYS . 48.7 t -80.81 136.15 36.07 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.321 1.058 . . . . 0.0 111.796 -175.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -138.51 158.41 70.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.81 -1.087 . . . . 0.0 108.202 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HA ' ' CG ' ' A' ' 34' ' ' TRP . 54.5 Cg_exo -61.72 178.46 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 121.442 1.428 . . . . 0.0 114.123 -179.177 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -61.8 -44.94 95.87 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.431 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -63.55 -26.5 68.73 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -76.05 133.01 40.46 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.507 -173.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.1 mt -81.3 131.12 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.913 0.864 . . . . 0.0 110.051 -175.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -86.42 134.54 33.69 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -133.7 113.76 12.99 Favored Pre-proline 0 C--N 1.325 -0.491 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -177.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.19 160.69 96.04 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 123.397 -1.501 . . . . 0.0 112.239 5.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.37 -26.66 10.14 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 121.837 1.692 . . . . 0.0 113.268 -174.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 84.6 p -71.23 -24.92 62.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.436 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.7 m -91.99 71.49 5.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.825 0.821 . . . . 0.0 109.851 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -142.81 119.57 11.18 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.52 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 71.6 m-85 -83.81 176.32 9.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.796 177.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.39 -133.4 5.82 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 119.422 -1.371 . . . . 0.0 110.718 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -76.4 117.34 17.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.416 -0.913 . . . . 0.0 108.877 176.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.52 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 82.9 mtp -122.44 -106.3 0.36 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.625 -175.055 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HB2' ' H ' ' A' ' 4' ' ' CYS . 15.5 t70 -95.4 50.67 1.26 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.545 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 p -157.47 -89.2 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.323 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -159.64 -173.39 4.11 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.643 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 18.3 t-105 -54.94 -62.46 1.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -83.71 1.55 42.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.484 -0.886 . . . . 0.0 112.927 -170.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.435 ' CG ' ' HA ' ' A' ' 13' ' ' PRO . 34.5 m0 -97.11 150.05 21.28 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.231 -0.918 . . . . 0.0 109.157 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.38 159.46 24.16 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.977 -174.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.448 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 8.8 t -111.24 116.2 30.63 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.257 175.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.28 126.68 33.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.851 0.834 . . . . 0.0 110.209 -175.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.7 tttt . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 121.882 0.849 . . . . 0.0 109.028 178.5 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 121.285 0.564 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -77.35 -43.66 32.16 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.073 -177.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.47 ' SG ' ' SD ' ' A' ' 28' ' ' MET . 14.1 t -72.13 -29.1 63.73 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 119.237 -0.985 . . . . 0.0 113.553 -173.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -69.45 -31.67 70.13 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.329 -0.948 . . . . 0.0 111.404 176.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -66.15 -38.36 87.91 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.341 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -74.78 -49.18 21.77 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.271 175.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.89 80.31 0.46 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.69 169.58 42.07 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 119.023 -1.56 . . . . 0.0 112.757 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -118.99 150.22 40.31 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.6 m -80.46 137.42 36.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.198 0.999 . . . . 0.0 111.329 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -133.75 137.67 29.19 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.54 165.96 8.71 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 C-N-CA 121.548 1.499 . . . . 0.0 112.344 175.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -77.77 86.07 4.05 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.98 0.895 . . . . 0.0 109.602 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.402 ' HG3' ' HG3' ' A' ' 16' ' ' LYS . 13.4 pt-20 -150.19 -27.74 0.24 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.263 -176.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.402 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 25.2 mtpp -127.54 169.66 13.46 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.993 1.378 . . . . 0.0 112.533 -171.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.0 mt -77.95 137.17 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.3 t -86.54 117.32 25.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -137.13 114.27 9.83 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -169.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -70.23 164.62 80.11 Favored 'Cis proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.967 -1.68 . . . . 0.0 113.674 8.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -85.12 -24.26 2.14 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.588 1.526 . . . . 0.0 113.512 -169.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 85.9 p -66.59 -26.86 67.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.328 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -94.61 47.4 1.17 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.001 -0.68 . . . . 0.0 111.557 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -108.07 102.99 12.11 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.469 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 89.8 m-85 -79.61 161.03 26.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.3 -131.54 5.15 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 119.055 -1.545 . . . . 0.0 111.316 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -82.45 99.38 9.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.536 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 70.6 mtp -93.04 -112.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.131 -173.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.52 33.39 4.55 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.137 -0.977 . . . . 0.0 111.921 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 58.7 m -111.35 -83.24 0.58 Allowed 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.292 -178.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.7 ptp180 -158.38 -175.37 5.29 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 118.532 -1.267 . . . . 0.0 111.299 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -63.35 -48.7 76.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.947 -1.024 . . . . 0.0 113.016 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -97.44 23.68 7.37 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.435 -0.906 . . . . 0.0 113.113 -175.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -117.56 152.31 35.37 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.061 -1.024 . . . . 0.0 109.587 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -110.7 166.94 10.61 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.536 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 17.0 t -120.64 127.84 52.45 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 169.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 47.2 t -130.05 154.01 47.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.573 0.701 . . . . 0.0 109.617 -173.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.114 179.957 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt . . . . . 0 N--CA 1.469 0.477 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.08 -47.73 17.65 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.17 -0.956 . . . . 0.0 111.505 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.61 -36.8 70.91 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -173.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -76.71 -42.98 39.35 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.359 -0.838 . . . . 0.0 111.621 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -62.98 -43.45 98.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.048 -0.661 . . . . 0.0 112.445 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -68.7 -33.63 74.29 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.761 -0.776 . . . . 0.0 112.322 -178.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.62 92.89 1.22 Allowed Glycine 0 N--CA 1.465 0.599 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.82 170.84 31.28 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 119.233 -1.461 . . . . 0.0 111.662 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.26 144.01 38.21 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -79.7 132.98 36.34 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.976 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -140.13 157.08 69.78 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -51.36 142.61 37.14 Favored 'Trans proline' 0 CA--C 1.53 0.304 0 C-N-CA 121.507 1.472 . . . . 0.0 110.547 169.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.83 -14.35 61.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -92.76 -20.5 20.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -90.25 -106.49 0.09 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.112 -169.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.8 mt -115.81 132.51 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 122.758 1.266 . . . . 0.0 111.309 -173.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 t -132.99 123.59 26.16 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.265 -2.494 . . . . 0.0 104.265 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -118.35 117.13 34.96 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -76.52 165.24 85.73 Favored 'Cis proline' 0 CA--C 1.534 0.518 0 C-N-CA 123.131 -1.612 . . . . 0.0 111.815 6.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -49.36 -65.21 0.17 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.31 2.007 . . . . 0.0 116.058 -168.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.7 m -97.75 65.23 1.82 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.063 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.2 m -154.17 108.83 3.06 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.396 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 1.8 p30 -160.76 149.22 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.373 1.082 . . . . 0.0 111.798 -176.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.439 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 99.0 m-85 -84.41 164.62 18.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.49 -140.98 2.21 Favored Glycine 0 N--CA 1.466 0.663 0 C-N-CA 119.552 -1.308 . . . . 0.0 111.806 -172.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -80.59 100.0 8.4 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 122.736 1.255 . . . . 0.0 108.357 176.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.635 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 93.7 mtp -90.2 -81.24 0.3 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.633 -172.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -148.06 57.84 1.09 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 119.548 -0.861 . . . . 0.0 110.713 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.3 m -135.13 -102.15 0.22 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.852 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -135.81 166.78 22.49 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.456 -0.777 . . . . 0.0 109.331 -172.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -57.51 -60.19 4.03 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -85.77 14.35 6.01 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.704 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.0 m0 -111.7 132.19 54.79 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.128 -0.983 . . . . 0.0 108.685 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.435 ' HZ2' ' CG ' ' A' ' 24' ' ' ASP . 22.0 pttp -115.18 158.74 21.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.894 0.854 . . . . 0.0 110.431 179.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.635 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 44.7 t -91.83 115.21 27.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -78.77 148.3 33.03 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.804 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt . . . . . 0 N--CA 1.47 0.557 0 CA-C-O 121.383 0.611 . . . . 0.0 110.973 -171.363 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 tptt . . . . . 0 N--CA 1.468 0.433 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.6 -61.61 1.94 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.814 -0.754 . . . . 0.0 112.412 -172.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.587 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 72.4 m -78.59 -33.94 47.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.189 -1.004 . . . . 0.0 113.391 -174.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -72.31 -41.42 66.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.192 -0.943 . . . . 0.0 112.867 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -65.55 -34.62 78.68 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.551 178.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -74.44 -47.86 31.06 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.455 173.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.11 69.17 0.18 Allowed Glycine 0 N--CA 1.465 0.593 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.991 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.47 -178.06 33.13 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 119.342 -1.408 . . . . 0.0 111.853 -177.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -155.51 158.93 39.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.9 m -78.81 120.27 23.2 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.338 -176.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 92.0 m-85 -120.02 152.3 54.0 Favored Pre-proline 0 N--CA 1.469 0.509 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.428 ' HA ' ' CD1' ' A' ' 34' ' ' TRP . 46.6 Cg_exo -69.52 153.29 70.21 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 121.37 1.38 . . . . 0.0 113.03 -175.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -68.89 -25.35 64.56 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.67 -26.46 66.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -91.54 137.26 32.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.748 0.785 . . . . 0.0 109.598 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.7 mt -85.93 124.78 40.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.778 -174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.1 t -93.77 138.46 31.93 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -125.46 122.87 24.99 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -171.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -81.0 165.99 75.23 Favored 'Cis proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.398 -1.501 . . . . 0.0 112.57 7.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.72 -12.39 15.03 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 121.723 1.615 . . . . 0.0 113.548 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.1 t -102.8 45.27 0.97 Allowed 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.452 -0.78 . . . . 0.0 111.512 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.0 p -160.55 63.73 0.32 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.862 0.839 . . . . 0.0 109.52 177.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -153.43 135.57 14.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.157 0.98 . . . . 0.0 109.114 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.715 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 82.7 m-85 -92.21 168.24 11.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.786 0.803 . . . . 0.0 109.4 179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.12 -116.05 2.68 Favored Glycine 0 N--CA 1.466 0.649 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.025 -174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -86.22 78.83 9.27 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.286 -0.965 . . . . 0.0 109.56 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.715 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.2 mtp -78.72 -85.28 0.08 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.8 p30 -120.94 40.52 3.53 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.045 0.926 . . . . 0.0 109.141 169.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 70.9 m -111.91 178.46 4.31 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.861 0.839 . . . . 0.0 110.557 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -95.35 -168.48 1.8 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.104 0.954 . . . . 0.0 111.24 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -55.69 -60.3 3.64 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -80.68 -6.01 57.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.428 ' CD1' ' HA ' ' A' ' 13' ' ' PRO . 42.4 m0 -111.38 163.54 13.89 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.853 -1.155 . . . . 0.0 110.509 -172.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -147.64 166.67 26.71 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 57.8 m -94.0 120.25 33.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.059 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 t -97.02 142.76 28.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.955 174.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 121.546 0.689 . . . . 0.0 109.208 -179.309 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.5 tptm . . . . . 0 N--CA 1.464 0.258 0 CA-C-O 120.875 0.369 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -77.77 -51.47 10.48 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 119.848 -0.741 . . . . 0.0 112.016 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.7 t -58.87 -40.52 84.6 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -176.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -77.93 -39.04 44.08 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 119.503 -0.879 . . . . 0.0 112.444 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -72.56 -35.07 67.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.369 -0.832 . . . . 0.0 112.41 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -65.04 -42.96 93.84 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.51 -0.744 . . . . 0.0 111.499 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.84 76.53 0.15 Allowed Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.884 -1.151 . . . . 0.0 110.527 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -179.73 -179.16 48.76 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 118.897 -1.62 . . . . 0.0 112.125 -177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -136.43 144.23 44.33 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.7 t -79.72 132.86 36.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.27 1.033 . . . . 0.0 111.836 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.25 153.19 70.9 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -56.88 168.87 2.15 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 121.647 1.565 . . . . 0.0 112.905 175.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -80.28 -9.31 59.73 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.25 47.27 2.42 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.2 1.0 . . . . 0.0 111.915 -172.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -145.14 175.04 10.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.94 0.876 . . . . 0.0 110.255 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -90.74 122.85 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.734 0.778 . . . . 0.0 110.337 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.5 p -123.47 152.85 41.27 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.04 116.87 51.06 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -84.67 159.87 67.18 Favored 'Cis proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.297 -1.543 . . . . 0.0 112.05 9.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . 0.412 ' HG2' ' H ' ' A' ' 22' ' ' SER . 64.8 Cg_endo -82.73 -57.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 121.361 1.374 . . . . 0.0 112.781 -171.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.412 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 38.8 m -92.98 58.69 3.01 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.374 -173.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 t -164.2 88.19 0.51 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.77 159.38 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.61 1.195 . . . . 0.0 111.875 -173.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.531 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 80.8 m-85 -97.71 179.22 4.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.497 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.07 -130.46 5.79 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 119.526 -1.321 . . . . 0.0 110.699 -176.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -81.93 109.08 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 118.954 -1.098 . . . . 0.0 108.787 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.612 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.3 mtp -107.45 -121.1 0.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.24 66.05 1.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.6 t -146.55 -142.25 0.13 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -83.41 160.6 21.56 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 120.943 -1.098 . . . . 0.0 109.997 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.3 t-105 -55.43 -38.1 68.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -110.45 14.15 22.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -104.89 151.85 23.35 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.036 -1.04 . . . . 0.0 109.867 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HB2' ' HZ3' ' A' ' 35' ' ' LYS . 10.5 mtmp? -110.3 165.81 11.47 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.067 0.937 . . . . 0.0 110.992 -175.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.612 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 50.3 t -114.66 113.14 23.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -177.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 93.1 m -78.34 144.7 35.8 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.423 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 121.732 0.777 . . . . 0.0 110.337 -173.724 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt . . . . . 0 N--CA 1.467 0.379 0 CA-C-O 120.655 0.264 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -78.24 -50.74 11.31 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 119.696 -0.801 . . . . 0.0 112.411 -174.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.696 ' SG ' ' CB ' ' A' ' 28' ' ' MET . 86.5 m -62.96 -30.48 71.61 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.644 -0.822 . . . . 0.0 113.183 -177.604 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -72.13 -31.15 65.73 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.791 -0.764 . . . . 0.0 112.342 -179.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -71.55 -42.57 67.71 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.521 -0.737 . . . . 0.0 111.648 176.85 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.16 -44.9 59.31 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.447 -179.521 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.69 70.89 0.3 Allowed Glycine 0 N--CA 1.465 0.6 0 C-N-CA 120.031 -1.081 . . . . 0.0 110.406 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.32 159.32 30.35 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 119.627 -1.273 . . . . 0.0 110.534 -179.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -112.4 145.53 39.97 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 9.0 m -79.33 134.2 36.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.206 1.003 . . . . 0.0 110.873 179.335 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -142.5 154.57 63.58 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 176.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.07 161.51 2.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 121.648 1.565 . . . . 0.0 112.79 172.101 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -62.19 -29.48 70.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -178.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.58 -25.26 63.89 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.551 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -87.2 135.66 33.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.188 0.994 . . . . 0.0 110.728 -171.033 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -128.55 130.84 69.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.911 -176.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 29.2 p -91.91 101.85 14.42 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 170.414 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.7 tp -70.7 138.28 85.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.312 -172.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -85.04 168.08 52.62 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 123.647 -1.397 . . . . 0.0 112.618 8.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -93.19 52.27 0.41 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 121.333 1.355 . . . . 0.0 111.649 -169.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.7 t -92.37 -59.4 2.09 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.981 -174.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -100.19 82.31 2.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.01 0.909 . . . . 0.0 109.386 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -109.82 103.79 12.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 35' ' ' LYS . 52.5 m-85 -82.04 158.25 23.86 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.842 -0.743 . . . . 0.0 109.713 -177.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.3 -137.37 5.76 Favored Glycine 0 N--CA 1.468 0.792 0 C-N-CA 119.779 -1.201 . . . . 0.0 111.695 -174.393 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -76.01 104.89 6.76 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.355 1.074 . . . . 0.0 108.959 176.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.696 ' CB ' ' SG ' ' A' ' 4' ' ' CYS . 66.7 mmm -95.58 -76.36 0.5 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.844 -172.799 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -153.41 58.74 0.76 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.9 0.857 . . . . 0.0 110.1 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.5 m -141.45 -71.23 0.35 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.7 -175.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -151.26 165.55 33.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.866 0.841 . . . . 0.0 109.544 -177.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -60.48 -48.56 81.22 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -177.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -100.5 13.62 34.0 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.736 -0.785 . . . . 0.0 112.991 -177.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -108.27 165.81 11.22 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -146.73 174.9 11.04 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -175.558 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 99.1 m -110.29 123.74 50.37 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.612 176.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 18' ' ' CYS . 45.1 t -104.96 149.67 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.117 0.961 . . . . 0.0 110.508 -177.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? . . . . . 0 C--N 1.325 -0.469 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -176.974 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.1 tptm . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 121.131 0.491 . . . . 0.0 109.982 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -78.99 -50.56 10.91 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.838 -172.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.8 t -70.94 -32.88 69.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 119.087 -1.045 . . . . 0.0 112.629 -172.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -67.52 -36.31 80.78 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.079 178.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.55 -42.7 95.54 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.573 179.012 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -72.46 -45.63 58.63 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.325 177.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 124.11 77.79 0.35 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.594 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.58 174.31 38.94 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 119.262 -1.447 . . . . 0.0 111.91 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -141.25 154.56 45.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.165 0.983 . . . . 0.0 109.655 -178.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.6 t -79.09 123.89 27.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.936 0.874 . . . . 0.0 111.39 -175.622 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -136.45 159.27 71.26 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.145 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.66 149.02 51.42 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.788 1.659 . . . . 0.0 112.678 177.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -73.08 -52.04 15.8 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.927 -176.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.84 -26.28 68.26 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -176.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -77.06 147.03 36.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.972 0.891 . . . . 0.0 110.722 -178.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.3 mt -71.16 135.7 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 122.214 1.007 . . . . 0.0 110.938 -177.049 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.7 t -95.0 116.3 28.52 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 168.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -124.43 117.42 26.56 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -172.512 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.19 159.29 93.04 Favored 'Cis proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.298 -1.542 . . . . 0.0 111.949 6.086 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -94.58 55.63 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 121.532 1.488 . . . . 0.0 111.56 -169.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.3 p -67.94 -64.01 0.95 Allowed 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.767 -0.773 . . . . 0.0 112.305 -173.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.1 m -144.18 112.72 6.55 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 119.359 -0.937 . . . . 0.0 110.465 -179.364 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -98.35 118.36 34.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.08 0.943 . . . . 0.0 109.347 175.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.67 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 78.0 m-85 -92.3 165.85 12.89 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.606 178.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -77.91 -134.48 0.78 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 119.599 -1.286 . . . . 0.0 111.832 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -84.47 90.38 7.6 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.507 178.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.67 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 84.2 mtp -95.34 -115.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.459 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -91.36 75.52 6.03 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 171.348 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.7 t -148.2 168.21 23.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.074 -1.051 . . . . 0.0 110.986 -170.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.454 ' HG2' ' H ' ' A' ' 32' ' ' TRP . 70.0 ttt180 -73.6 178.07 4.96 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.537 0.684 . . . . 0.0 110.627 -175.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.454 ' H ' ' HG2' ' A' ' 31' ' ' ARG . 59.1 t-105 -55.79 -60.75 3.01 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.492 -0.755 . . . . 0.0 112.826 -172.14 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -95.44 24.03 5.48 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.6 -0.84 . . . . 0.0 112.432 178.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.3 m0 -112.28 163.46 14.36 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.138 -0.976 . . . . 0.0 110.024 -177.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -125.64 168.28 13.94 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.987 -178.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 t -106.79 133.09 51.98 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.326 176.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 49.7 t -120.49 145.3 47.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 122.178 0.99 . . . . 0.0 112.083 -173.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.999 173.581 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 69.0 mttm . . . . . 0 N--CA 1.469 0.485 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -72.06 -50.57 27.24 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.758 -177.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.5 t -77.18 -29.45 54.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.652 -0.819 . . . . 0.0 112.276 -176.48 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -68.16 -36.07 79.06 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.803 -0.759 . . . . 0.0 111.524 175.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -66.22 -42.66 88.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.478 177.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.97 -49.58 50.27 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.011 174.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.82 85.24 0.58 Allowed Glycine 0 N--CA 1.465 0.629 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.3 -176.52 39.87 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.541 -1.314 . . . . 0.0 111.314 -178.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -143.82 138.0 28.38 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.66 -0.816 . . . . 0.0 109.377 -178.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.5 m -80.14 135.01 36.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.451 1.12 . . . . 0.0 111.149 179.146 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -129.22 145.57 57.26 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.056 175.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HA ' ' CD1' ' A' ' 34' ' ' TRP . 58.7 Cg_exo -56.37 166.16 3.69 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.686 1.591 . . . . 0.0 113.208 177.389 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -59.41 -45.46 91.48 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.675 178.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.84 -27.15 69.13 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -175.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -86.97 134.49 33.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.132 0.967 . . . . 0.0 110.369 -172.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.4 mt -112.58 124.97 69.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.001 -171.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.4 p -94.33 137.06 33.93 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 168.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.83 120.58 55.23 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -86.02 159.01 57.77 Favored 'Cis proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.236 -1.568 . . . . 0.0 112.219 9.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.81 -27.04 4.18 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 121.743 1.629 . . . . 0.0 113.198 -173.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.441 ' C ' ' HG ' ' A' ' 23' ' ' SER . 95.7 p -85.28 59.57 5.71 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.478 -0.764 . . . . 0.0 110.763 -179.462 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.441 ' HG ' ' C ' ' A' ' 22' ' ' SER . 64.7 m -162.44 80.73 0.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -158.59 147.33 18.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.124 0.964 . . . . 0.0 110.595 -175.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.504 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 84.4 m-85 -82.05 160.23 23.27 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.481 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -121.4 0.6 Allowed Glycine 0 N--CA 1.465 0.606 0 C-N-CA 119.244 -1.455 . . . . 0.0 110.754 -175.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -88.29 95.89 10.36 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.445 -0.902 . . . . 0.0 108.63 177.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.504 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.9 mtp -86.98 -108.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.53 50.61 0.8 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.96 0.886 . . . . 0.0 110.109 174.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.2 m -141.41 177.97 7.75 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -177.354 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -74.02 -178.85 3.48 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.272 1.034 . . . . 0.0 112.228 -171.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -57.17 -52.58 64.73 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -172.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -89.82 -3.26 58.22 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.566 -0.854 . . . . 0.0 113.104 -171.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.419 ' CD1' ' HA ' ' A' ' 13' ' ' PRO . 36.4 m0 -99.59 147.11 25.71 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.817 -1.177 . . . . 0.0 109.469 -178.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -124.43 155.57 38.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -174.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.469 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 6.5 t -99.54 114.14 26.96 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.922 -1.111 . . . . 0.0 109.762 176.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.1 t -86.45 144.56 27.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.241 1.019 . . . . 0.0 111.171 -174.202 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.9 tptp . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.348 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttp . . . . . 0 N--CA 1.469 0.494 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -75.12 -49.26 20.15 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.195 -0.94 . . . . 0.0 112.771 -170.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 83.7 m -62.46 -32.79 73.72 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.294 -0.878 . . . . 0.0 112.206 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -71.88 -29.86 64.8 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.163 -0.615 . . . . 0.0 112.375 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -66.11 -43.3 87.6 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.59 -0.694 . . . . 0.0 111.732 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -72.9 -36.33 67.27 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 119.499 -0.88 . . . . 0.0 111.579 176.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.42 57.35 0.29 Allowed Glycine 0 N--CA 1.467 0.761 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.509 175.299 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -158.02 -170.59 22.94 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 119.632 -1.27 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -142.41 161.0 39.16 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.123 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 88.1 m -79.82 144.1 33.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.089 0.947 . . . . 0.0 111.087 175.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -135.26 145.55 54.45 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.036 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.2 153.91 55.72 Favored 'Trans proline' 0 C--N 1.332 -0.29 0 C-N-CA 121.556 1.504 . . . . 0.0 112.284 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -84.13 79.99 9.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.243 1.02 . . . . 0.0 110.205 -176.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -154.23 -35.84 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.773 178.495 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -93.24 156.2 16.97 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.887 0.851 . . . . 0.0 109.69 177.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.9 mt -87.13 130.65 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.096 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.2 t -86.8 131.31 34.16 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.676 173.127 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -122.96 119.81 27.75 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -173.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.84 161.06 83.2 Favored 'Cis proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.423 -1.49 . . . . 0.0 111.951 6.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -80.07 -7.96 14.22 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 121.69 1.594 . . . . 0.0 113.499 -176.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -71.51 -42.82 67.51 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.443 -0.786 . . . . 0.0 111.794 -178.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -88.56 65.75 7.94 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 122.309 1.052 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -118.41 120.1 36.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.584 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.8 m-85 -102.6 153.09 20.44 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.746 -0.782 . . . . 0.0 109.473 -175.51 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.98 -118.86 2.15 Favored Glycine 0 N--CA 1.466 0.639 0 C-N-CA 119.391 -1.385 . . . . 0.0 111.419 -171.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -83.37 81.54 8.67 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.178 178.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.584 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 86.6 mtp -83.37 -71.52 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.083 -179.716 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.449 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 35.3 t70 -126.9 31.48 5.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.571 0.701 . . . . 0.0 109.813 178.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 95.0 m -150.66 178.4 9.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 122.185 0.993 . . . . 0.0 110.86 -171.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -77.8 -175.44 3.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 122.253 1.025 . . . . 0.0 112.162 -171.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.1 t-105 -63.36 -51.43 65.93 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.379 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.39 6.52 11.96 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.888 -175.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 14.2 m0 -121.31 156.72 31.96 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -142.96 161.72 37.38 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.144 -177.44 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 43.2 m -102.02 153.88 19.48 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 119.651 -0.819 . . . . 0.0 110.054 174.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -149.82 156.7 42.26 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.933 -179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt . . . . . 0 C--N 1.325 -0.47 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 173.905 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 N--CA 1.467 0.379 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -77.94 -49.67 13.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 119.499 -0.881 . . . . 0.0 112.011 -177.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.94 -36.99 75.7 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.997 -179.301 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -74.29 -37.98 63.51 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.012 178.797 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -67.77 -38.01 82.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.946 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -64.88 -37.3 87.16 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.615 176.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.42 66.85 0.68 Allowed Glycine 0 N--CA 1.466 0.681 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -178.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.97 170.74 30.72 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 119.503 -1.332 . . . . 0.0 111.48 -176.921 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -126.94 152.01 47.71 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 176.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.8 m -80.71 135.5 36.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.167 0.984 . . . . 0.0 111.418 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.9 m-85 -139.11 143.87 38.52 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.178 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.77 163.23 2.05 Favored 'Trans proline' 0 C--N 1.331 -0.361 0 C-N-CA 121.657 1.571 . . . . 0.0 112.213 171.051 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -85.12 45.9 1.22 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.713 -174.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -145.41 -29.02 0.44 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -173.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -87.44 172.82 9.52 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.273 1.035 . . . . 0.0 111.961 -171.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.48 139.97 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 122.381 1.086 . . . . 0.0 110.284 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -116.12 142.65 46.53 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 168.586 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -135.41 114.76 11.5 Favored Pre-proline 0 C--N 1.325 -0.49 0 C-N-CA 119.301 -0.96 . . . . 0.0 108.61 -174.094 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.97 158.75 96.24 Favored 'Cis proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.375 -1.511 . . . . 0.0 111.699 2.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.92 -27.79 0.87 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.163 1.242 . . . . 0.0 114.444 -168.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.406 ' C ' ' HG ' ' A' ' 23' ' ' SER . 50.5 m -94.7 59.26 2.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.15 -0.969 . . . . 0.0 111.434 -172.086 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.406 ' HG ' ' C ' ' A' ' 22' ' ' SER . 41.4 m -166.18 69.16 0.12 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 175.478 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -128.45 130.27 47.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 122.171 0.986 . . . . 0.0 110.538 -176.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 23.5 m-85 -86.56 170.06 12.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.22 178.426 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.03 -137.84 6.34 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 119.54 -1.314 . . . . 0.0 111.202 -178.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -76.22 115.3 15.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.335 177.858 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' MET . . . . . 0.593 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.1 mtp -119.42 -95.95 0.48 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.72 -0.792 . . . . 0.0 109.051 -175.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.519 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 2.9 m-20 -107.79 53.71 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.33 179.602 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.519 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 58.2 m -152.2 -163.63 1.78 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.94 -178.88 5.73 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 120.932 -1.105 . . . . 0.0 111.681 -171.674 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -58.23 -51.78 68.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -171.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -95.56 7.55 45.92 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.614 -0.834 . . . . 0.0 113.191 -170.156 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -104.05 162.09 13.44 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.117 -0.989 . . . . 0.0 109.781 -178.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -132.66 167.3 20.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.971 -174.683 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.593 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 43.2 t -114.28 106.9 14.89 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.653 -174.093 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 t -92.65 148.4 22.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.161 -1.016 . . . . 0.0 111.801 -174.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--N 1.326 -0.434 0 CA-C-O 121.893 0.854 . . . . 0.0 109.098 178.942 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 120.949 0.404 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -77.46 -40.98 41.3 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.0 -176.172 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 10.5 t -73.1 -28.28 62.18 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.673 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -67.34 -28.78 68.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -174.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -54.88 -43.71 73.41 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 119.539 -0.865 . . . . 0.0 110.877 171.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -74.86 -48.99 22.09 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.723 173.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.28 84.5 1.18 Allowed Glycine 0 N--CA 1.467 0.729 0 C-N-CA 120.277 -0.963 . . . . 0.0 110.853 178.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.73 163.82 32.83 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 119.135 -1.507 . . . . 0.0 112.616 -176.68 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -120.83 154.93 35.11 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.651 0.739 . . . . 0.0 109.305 177.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.7 m -80.53 139.14 36.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.258 1.028 . . . . 0.0 111.574 -178.156 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -142.59 158.57 59.88 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 172.791 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.51 175.56 2.72 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 121.475 1.45 . . . . 0.0 113.395 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -93.39 75.46 4.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.614 0.721 . . . . 0.0 110.459 -176.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -169.29 -32.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.422 -177.436 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -85.47 172.18 11.2 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.55 1.167 . . . . 0.0 112.088 -173.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -87.74 134.01 28.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.816 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.65 105.25 17.36 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 171.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.401 ' HA ' ' C ' ' A' ' 20' ' ' PRO . 23.9 tp -118.75 132.52 23.85 Favored Pre-proline 0 N--CA 1.469 0.48 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.173 -169.313 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.401 ' C ' ' HA ' ' A' ' 19' ' ' LEU . 62.2 Cg_exo -66.3 167.66 52.73 Favored 'Cis proline' 0 CA--C 1.532 0.411 0 CA-C-N 120.988 1.388 . . . . 0.0 114.0 4.427 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.81 75.16 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 121.444 1.429 . . . . 0.0 111.122 -169.076 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.2 p -140.05 -66.35 0.45 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.511 -177.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.9 m -99.39 81.95 2.6 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.713 0.768 . . . . 0.0 111.27 -172.474 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -106.61 118.08 35.74 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 172.505 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -95.7 153.74 17.57 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.7 -176.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.49 -122.77 1.97 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 119.667 -1.254 . . . . 0.0 111.363 -177.072 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -75.69 99.64 4.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 119.219 -0.992 . . . . 0.0 109.12 175.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 90.1 mmm -99.43 -120.39 0.15 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 176.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -103.62 40.77 1.37 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.089 -1.045 . . . . 0.0 110.714 170.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.9 m -93.97 -165.47 1.33 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 170.341 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -86.04 -171.21 3.46 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.752 -1.218 . . . . 0.0 109.918 176.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -59.47 -45.59 91.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -170.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -107.82 15.93 24.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -173.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -111.77 172.77 6.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.115 -0.991 . . . . 0.0 110.404 178.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HB2' ' HZ1' ' A' ' 35' ' ' LYS . 9.7 mtmp? -135.89 171.03 15.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.153 -0.619 . . . . 0.0 111.003 -174.919 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.3 t -113.71 143.42 44.64 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.787 -0.57 . . . . 0.0 109.94 177.164 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 19.5 t -125.26 143.2 51.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.851 0.834 . . . . 0.0 111.444 -175.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.1 tttt . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 173.252 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 47.4 p90 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -79.89 -55.21 5.14 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.169 -0.957 . . . . 0.0 111.736 -170.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -76.72 -47.85 20.61 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.502 -0.749 . . . . 0.0 112.082 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.655 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -64.03 -40.27 95.96 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -172.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -66.95 -29.39 69.24 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -70.96 -48.78 51.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.763 -0.586 . . . . 0.0 112.549 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.88 -50.13 25.67 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.264 -0.898 . . . . 0.0 112.182 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.79 69.1 0.06 OUTLIER Glycine 0 N--CA 1.469 0.838 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.95 163.92 37.09 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.304 -176.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -137.49 144.03 42.02 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 92.9 m -78.77 133.57 37.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.151 0.977 . . . . 0.0 111.44 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -139.86 146.87 48.94 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.62 152.95 15.31 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.641 1.56 . . . . 0.0 112.527 171.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -23.61 60.98 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -89.45 -23.53 22.09 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -79.63 155.7 27.98 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.238 1.018 . . . . 0.0 111.583 -173.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.64 130.54 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 122.19 0.995 . . . . 0.0 112.049 -173.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.4 t -108.94 139.15 44.19 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 166.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.2 111.31 12.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.67 159.38 96.71 Favored 'Cis proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.957 7.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -86.04 -38.11 0.1 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 121.341 1.361 . . . . 0.0 114.904 -168.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.2 t -93.6 62.43 3.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.934 0.873 . . . . 0.0 111.859 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.6 p -162.53 98.27 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -150.39 141.86 23.42 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.781 1.277 . . . . 0.0 113.259 -170.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.496 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 62.5 m-85 -94.27 159.92 14.91 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.141 169.077 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.15 -124.95 2.52 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.378 -175.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.85 77.45 10.09 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.644 1.211 . . . . 0.0 110.281 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.655 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 96.4 mtp -73.42 -64.02 1.07 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.183 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.477 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 30.1 t70 -138.44 44.5 2.1 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.666 0.746 . . . . 0.0 109.367 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 86.5 m -153.35 -176.81 5.96 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.92 0.867 . . . . 0.0 110.76 -171.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -79.84 -177.68 6.06 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.245 1.021 . . . . 0.0 112.754 -170.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -60.89 -56.86 16.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -77.12 -4.41 44.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -175.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -108.58 153.01 23.98 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.166 -0.959 . . . . 0.0 109.334 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -140.19 153.56 46.65 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.641 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 35.7 m -91.07 124.22 35.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.246 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.0 t -79.15 155.88 28.49 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.304 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -114.69 129.15 56.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.501 0.667 . . . . 0.0 110.895 -169.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -145.96 -63.54 0.32 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.042 173.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.92 0.94 Allowed Glycine 0 N--CA 1.469 0.873 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.308 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.6 p -85.36 64.46 8.67 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.63 -0.924 . . . . 0.0 111.816 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 C-N-CA 120.279 -0.963 . . . . 0.0 111.898 173.819 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 83.1 t80 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -75.75 -60.44 2.32 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.21 -0.931 . . . . 0.0 112.369 -172.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.408 ' OE1' ' SD ' ' A' ' 28' ' ' MET . 46.0 tt0 -76.67 -44.62 33.07 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.382 -0.824 . . . . 0.0 112.995 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.645 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -66.15 -38.6 88.52 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.797 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -63.31 -31.12 72.18 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -62.96 -44.17 96.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.838 -0.539 . . . . 0.0 112.156 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -70.65 -45.88 64.31 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.495 -0.753 . . . . 0.0 111.737 172.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.77 83.93 0.9 Allowed Glycine 0 N--CA 1.468 0.781 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.06 -166.58 24.26 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 119.577 -1.296 . . . . 0.0 112.222 -175.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -147.05 152.15 38.07 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.761 0.791 . . . . 0.0 108.986 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.1 m -79.8 123.99 28.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.054 -0.658 . . . . 0.0 110.177 175.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' CD1' ' HB3' ' A' ' 37' ' ' CYS . 96.9 m-85 -126.35 148.36 63.6 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 175.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.13 156.66 19.7 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 121.592 1.528 . . . . 0.0 112.08 171.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -62.4 -31.16 71.8 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -99.25 -23.1 15.31 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -89.7 -161.22 0.76 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.529 -0.732 . . . . 0.0 111.75 -168.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.0 mt -79.1 139.19 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 122.707 1.242 . . . . 0.0 112.774 -169.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.2 t -116.02 144.48 44.05 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 166.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -141.65 110.58 6.23 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 119.461 -0.896 . . . . 0.0 108.866 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.99 154.4 87.81 Favored 'Cis proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.531 -1.445 . . . . 0.0 111.622 0.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -77.68 -33.53 2.27 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 121.273 1.315 . . . . 0.0 115.123 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.437 ' C ' ' HG ' ' A' ' 23' ' ' SER . 68.6 m -93.18 66.06 4.01 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.384 -0.823 . . . . 0.0 111.044 -174.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.495 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 55.4 m -163.74 74.64 0.33 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -101.33 141.85 33.59 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.548 1.166 . . . . 0.0 111.521 -172.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -117.59 152.45 35.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.031 175.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -76.03 -148.19 2.24 Favored Glycine 0 N--CA 1.47 0.967 0 C-N-CA 119.684 -1.246 . . . . 0.0 112.894 -173.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -81.11 95.29 6.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.815 1.293 . . . . 0.0 108.874 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.645 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 25.4 mmm -98.48 -74.52 0.58 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.844 -171.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -146.58 61.3 1.21 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 74.0 m -129.97 -103.0 0.3 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -149.27 -171.55 3.91 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.398 -0.814 . . . . 0.0 109.203 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -60.16 -55.98 27.22 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -171.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -94.41 10.83 32.84 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -109.85 164.74 12.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.445 1.117 . . . . 0.0 110.082 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -130.21 159.39 37.0 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.17 -176.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 43.9 m -90.01 157.08 17.98 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.102 -1.039 . . . . 0.0 108.768 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 23' ' ' SER . 11.1 t -158.23 -178.83 7.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.894 0.854 . . . . 0.0 109.105 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -78.06 140.33 39.11 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.829 0.823 . . . . 0.0 110.227 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HD3' ' H ' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -74.94 -47.49 29.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 -170.184 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.35 65.29 0.29 Allowed Glycine 0 N--CA 1.47 0.933 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.118 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.7 p -161.61 -51.25 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 109.77 175.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.198 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 178.332 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 71.1 t80 . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.123 0.487 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -173.81 -71.92 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.46 169.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -79.0 -55.51 5.07 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.725 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 77.8 m -62.98 -29.11 70.56 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.06 -29.55 67.7 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.303 -0.873 . . . . 0.0 112.494 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -58.7 -50.77 72.65 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.653 -0.655 . . . . 0.0 111.46 173.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.0 -47.11 81.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.303 172.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 103.61 55.84 0.78 Allowed Glycine 0 N--CA 1.468 0.791 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.466 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.69 -152.29 7.69 Favored Glycine 0 N--CA 1.468 0.803 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -150.47 148.72 29.07 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.17 0.986 . . . . 0.0 109.992 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.5 t -80.92 113.81 19.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.785 0.802 . . . . 0.0 110.786 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -124.73 157.65 65.18 Favored Pre-proline 0 N--CA 1.471 0.579 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.556 178.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -58.77 157.88 26.5 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.849 1.7 . . . . 0.0 113.793 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -63.27 -27.85 69.62 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.91 -30.37 58.75 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -74.48 154.48 38.69 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.228 1.013 . . . . 0.0 111.197 -171.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.0 mt -79.47 124.48 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 122.022 0.915 . . . . 0.0 111.077 -169.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 49.4 t -95.49 140.51 30.24 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 169.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.21 119.31 29.67 Favored Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.03 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 166.77 82.06 Favored 'Cis proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.402 -1.499 . . . . 0.0 111.419 1.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -51.36 -49.81 15.95 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 122.098 1.865 . . . . 0.0 115.464 -172.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.9 p -92.58 56.73 2.77 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.638 0.732 . . . . 0.0 111.818 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.8 m -145.34 69.89 1.25 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 122.426 1.108 . . . . 0.0 109.574 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 5.1 p30 -144.27 151.42 39.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.083 0.944 . . . . 0.0 109.12 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.63 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 36.1 m-85 -98.04 170.2 9.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.608 0.718 . . . . 0.0 109.07 175.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.08 -142.82 3.47 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.673 -1.251 . . . . 0.0 112.441 -171.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -79.16 81.98 5.37 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.782 1.277 . . . . 0.0 109.57 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.725 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 95.1 mtp -82.17 -111.02 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.466 -178.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -91.24 64.13 5.14 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 t -142.64 169.71 17.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -169.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 51.0 ttt85 -67.75 166.44 15.31 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.321 -0.862 . . . . 0.0 110.753 -177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -51.29 -46.84 62.62 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -108.88 28.23 8.67 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.238 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -111.51 168.91 9.18 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.301 -0.874 . . . . 0.0 109.347 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -135.46 149.1 49.47 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.484 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.7 m -89.48 114.91 26.48 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.803 0.811 . . . . 0.0 109.56 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 50.0 t -84.98 126.77 33.8 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.944 0.878 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -161.08 129.89 4.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -176.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -75.61 172.37 12.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 122.543 1.163 . . . . 0.0 111.827 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.75 -62.06 1.89 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 119.979 -1.105 . . . . 0.0 110.44 171.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.9 p -90.78 73.04 6.64 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.129 0.966 . . . . 0.0 109.674 173.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.156 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 t80 . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -123.08 167.5 13.58 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.412 1.101 . . . . 0.0 113.139 -168.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -68.75 -52.22 32.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.175 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.0 t -68.21 -29.54 68.41 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.351 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -68.76 -30.14 68.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.908 174.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -67.01 -36.24 81.7 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -82.47 -53.32 6.08 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.004 174.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.64 81.83 0.14 Allowed Glycine 0 N--CA 1.467 0.708 0 C-N-CA 119.992 -1.099 . . . . 0.0 110.582 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.75 170.33 40.5 Favored Glycine 0 N--CA 1.468 0.773 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.98 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -132.03 155.02 48.76 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.2 m -81.29 136.57 35.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.814 0.816 . . . . 0.0 112.282 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -134.1 149.63 72.02 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.05 173.49 0.9 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 121.885 1.724 . . . . 0.0 114.019 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.25 -48.9 16.3 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.524 -0.735 . . . . 0.0 111.487 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -29.88 70.95 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -86.42 137.52 32.49 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.727 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.4 mt -100.5 133.55 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 CA-C-O 121.795 0.807 . . . . 0.0 110.813 -170.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 p -102.39 149.51 24.29 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.4 tp -117.61 131.06 24.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -174.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.7 160.54 90.67 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.207 1.467 . . . . 0.0 113.363 5.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -85.19 -30.6 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 121.254 1.303 . . . . 0.0 113.996 -169.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.5 m -93.45 52.62 1.76 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.312 -0.868 . . . . 0.0 110.771 178.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -150.23 77.88 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.65 0.738 . . . . 0.0 109.193 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -157.95 158.9 35.85 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.311 1.053 . . . . 0.0 111.245 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.446 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 57.7 m-85 -99.66 170.04 8.85 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.342 -0.845 . . . . 0.0 109.645 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.09 -133.76 4.39 Favored Glycine 0 N--CA 1.47 0.902 0 C-N-CA 119.806 -1.188 . . . . 0.0 112.907 -170.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -84.92 86.88 7.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.16 0.981 . . . . 0.0 108.471 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.446 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 74.1 mtp -84.5 -76.26 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.894 -171.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -128.72 12.02 6.26 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 79.9 m -114.1 -157.78 0.64 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.62 -0.675 . . . . 0.0 109.578 178.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -78.88 -178.87 6.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.377 1.084 . . . . 0.0 111.92 -171.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -63.51 -49.06 75.02 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -176.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -91.22 18.54 6.84 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -113.84 156.17 24.4 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -135.17 157.2 47.52 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.081 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.5 t -98.39 107.93 20.51 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.808 -176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.0 t -97.33 148.64 22.93 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.284 1.04 . . . . 0.0 111.571 -172.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -141.56 137.57 32.06 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.909 176.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -94.28 -68.98 0.77 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.897 0.856 . . . . 0.0 110.367 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.32 -73.8 0.06 OUTLIER Glycine 0 N--CA 1.466 0.658 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 -177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.4 m -85.16 59.84 5.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 108.68 168.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.149 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 55.1 t80 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -84.19 -58.77 2.63 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 119.68 -0.808 . . . . 0.0 112.06 -169.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.19 -49.88 14.19 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.342 -173.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.6 t -77.36 -28.65 53.0 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -70.77 -33.84 71.18 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.135 -0.978 . . . . 0.0 112.832 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -76.91 -39.36 51.13 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.726 -0.609 . . . . 0.0 111.629 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -71.75 -35.63 70.17 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.498 -0.751 . . . . 0.0 112.299 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.22 90.66 2.0 Favored Glycine 0 N--CA 1.47 0.934 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.824 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.1 146.25 9.78 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 119.52 -1.324 . . . . 0.0 112.324 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -101.57 143.8 31.11 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 175.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' SG ' ' HE3' ' A' ' 34' ' ' TRP . 42.3 t -85.54 131.32 34.39 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.361 -0.837 . . . . 0.0 111.864 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -132.73 154.08 81.32 Favored Pre-proline 0 N--CA 1.471 0.62 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.79 163.47 15.91 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.836 1.69 . . . . 0.0 111.599 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.67 -4.62 16.3 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.33 -21.16 42.78 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -87.16 152.26 22.48 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.028 0.918 . . . . 0.0 112.57 -169.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -83.2 135.92 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 121.822 0.82 . . . . 0.0 109.05 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -96.09 119.16 34.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.726 0.774 . . . . 0.0 110.509 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.7 tp -121.35 134.36 24.47 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.88 168.33 76.85 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 123.676 -1.385 . . . . 0.0 111.72 2.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -58.53 -51.07 7.97 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.606 1.537 . . . . 0.0 114.777 -170.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.485 ' C ' ' HG ' ' A' ' 23' ' ' SER . 70.5 m -90.5 58.91 4.12 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.616 0.722 . . . . 0.0 111.468 -177.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.485 ' HG ' ' C ' ' A' ' 22' ' ' SER . 67.9 m -162.48 83.2 0.54 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.14 0.971 . . . . 0.0 108.672 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -157.33 160.8 38.87 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.61 0.719 . . . . 0.0 109.104 -171.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.9 m-85 -135.54 163.96 28.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.816 0.817 . . . . 0.0 110.14 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.05 -143.31 5.65 Favored Glycine 0 N--CA 1.47 0.911 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.093 -176.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -77.68 98.4 5.46 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.317 1.055 . . . . 0.0 109.016 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.554 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 85.2 mtp -90.19 -113.63 0.07 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.584 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -110.62 68.64 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.8 t -142.26 -88.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -141.47 155.37 45.84 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -55.85 -34.15 65.17 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -109.49 15.34 23.04 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.421 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 33.0 m0 -113.4 161.57 17.14 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.058 -1.026 . . . . 0.0 109.505 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -113.42 170.95 7.87 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.362 0.601 . . . . 0.0 110.364 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.516 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.9 t -119.92 97.15 5.47 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.443 -0.785 . . . . 0.0 109.174 173.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' SG ' ' HD2' ' A' ' 39' ' ' LYS . 43.3 t -86.12 150.54 24.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.768 0.794 . . . . 0.0 111.545 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -97.25 90.98 5.3 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.7 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HD2' ' SG ' ' A' ' 37' ' ' CYS . 20.8 ptmt -152.11 -145.36 0.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.248 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.54 -82.47 0.27 Allowed Glycine 0 N--CA 1.468 0.811 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 72.2 m -136.29 98.11 3.76 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -178.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.194 0 C-N-CA 119.357 -1.401 . . . . 0.0 112.37 179.806 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -87.19 -78.26 0.31 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.37 -0.832 . . . . 0.0 111.291 -171.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -77.38 -47.89 18.7 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.563 -0.71 . . . . 0.0 112.47 -174.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.7 t -62.99 -30.29 71.48 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -76.96 -38.09 53.94 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.459 -0.776 . . . . 0.0 112.092 174.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -69.82 -42.48 73.6 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.593 -0.692 . . . . 0.0 112.504 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -71.69 -63.02 1.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.316 -0.865 . . . . 0.0 111.235 177.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.84 83.7 0.05 OUTLIER Glycine 0 N--CA 1.467 0.723 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.627 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.19 163.76 37.43 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.664 -1.255 . . . . 0.0 111.242 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -123.78 147.28 47.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.6 m -78.47 125.28 29.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.755 0.788 . . . . 0.0 110.716 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -132.98 156.56 79.95 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.8 136.72 77.97 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.898 1.732 . . . . 0.0 112.294 175.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -76.87 -29.59 55.87 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -172.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.13 -28.26 69.94 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 172.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -81.52 144.76 31.09 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.096 0.95 . . . . 0.0 109.279 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -87.71 133.92 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.864 0.84 . . . . 0.0 111.203 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 57.7 m -74.67 131.08 40.59 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 168.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.51 116.58 31.94 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.79 163.49 85.88 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.482 -1.466 . . . . 0.0 112.56 7.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -72.01 -27.06 17.75 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.892 1.728 . . . . 0.0 113.834 -175.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.3 p -71.1 -28.92 64.66 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.51 -0.744 . . . . 0.0 112.804 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -84.46 81.9 8.64 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.483 -0.761 . . . . 0.0 109.395 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -150.29 130.38 13.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 122.575 1.179 . . . . 0.0 111.058 -173.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.615 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 26.9 m-85 -106.4 152.24 23.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.327 173.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.56 -133.92 3.67 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.914 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -80.52 83.89 6.23 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.754 1.264 . . . . 0.0 110.213 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.615 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 94.1 mtp -81.17 -69.1 0.63 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.857 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -151.72 57.65 0.86 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 84.9 m -123.32 -105.36 0.36 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -155.17 -169.21 3.1 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.349 -0.844 . . . . 0.0 109.114 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 45.7 t-105 -60.99 -51.76 67.88 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.31 -0.869 . . . . 0.0 112.987 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -85.58 -0.07 53.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -120.23 150.92 39.91 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.803 1.183 . . . . 0.0 109.767 -177.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -134.21 177.21 7.92 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.132 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -103.46 136.76 42.6 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.076 -1.015 . . . . 0.0 110.951 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 79.6 m -84.49 142.05 30.33 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -88.94 146.61 24.8 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.019 0.914 . . . . 0.0 110.391 -176.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -0.93 23.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.637 1.718 . . . . 0.0 115.637 -172.084 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.25 -112.12 0.5 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 119.538 -1.315 . . . . 0.0 110.954 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.0 t -75.52 -87.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.803 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.142 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.82 176.208 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.538 ' H1 ' ' CG ' ' A' ' 29' ' ' ASP . 79.2 t80 . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -59.92 -56.38 22.47 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -78.49 -44.5 24.32 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.39 -40.75 95.49 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -71.32 -36.43 71.58 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.635 -0.666 . . . . 0.0 112.213 176.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -67.64 -38.04 83.29 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -72.39 -51.75 19.04 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.178 -0.952 . . . . 0.0 111.629 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.58 72.91 0.03 OUTLIER Glycine 0 N--CA 1.467 0.752 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.113 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.52 -174.16 42.76 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 119.522 -1.323 . . . . 0.0 112.24 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -143.82 153.06 41.98 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.03 119.12 21.71 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.986 0.898 . . . . 0.0 110.773 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.89 152.38 75.24 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -60.03 168.93 5.3 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 121.49 1.46 . . . . 0.0 113.882 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -58.73 -51.39 70.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.373 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.0 -26.97 69.1 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.05 134.33 42.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 122.162 0.982 . . . . 0.0 109.969 176.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.1 mt -85.19 132.24 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-O 121.821 0.82 . . . . 0.0 111.356 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 94.0 m -78.23 136.52 37.8 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.8 117.93 30.84 Favored Pre-proline 0 N--CA 1.469 0.505 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -80.32 166.24 76.48 Favored 'Cis proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.269 -1.555 . . . . 0.0 112.846 8.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -59.35 -39.49 76.68 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 121.922 1.748 . . . . 0.0 115.102 -173.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -90.06 59.43 4.5 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.976 0.893 . . . . 0.0 110.823 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.3 t -161.27 85.75 0.67 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.444 ' OD1' ' SG ' ' A' ' 18' ' ' CYS . 27.8 t70 -157.23 126.68 6.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.743 -0.783 . . . . 0.0 109.572 -169.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -83.12 154.03 24.53 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.77 -129.87 1.16 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 119.68 -1.248 . . . . 0.0 112.092 -174.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HB2' ' HZ3' ' A' ' 27' ' ' LYS . 10.5 mtmp? -84.23 94.97 8.53 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.784 0.802 . . . . 0.0 108.981 177.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 40.9 mmm -89.5 -77.52 0.38 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.994 -172.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.538 ' CG ' ' H1 ' ' A' ' 1' ' ' TYR . 38.9 p30 -145.86 43.85 1.26 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.777 0.799 . . . . 0.0 111.454 -176.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 88.5 m -134.11 -151.21 0.43 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -83.04 -178.61 7.18 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.622 -1.299 . . . . 0.0 111.567 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.1 t-105 -57.95 -54.09 50.91 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -92.98 25.26 3.28 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -114.16 154.89 27.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 122.394 1.092 . . . . 0.0 110.012 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -120.29 164.1 16.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.965 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.6 t -110.85 112.19 23.87 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 169.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -78.62 143.8 36.06 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.238 -173.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -114.12 142.98 45.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.929 174.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HZ2' ' C ' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -76.52 178.81 6.35 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.898 0.856 . . . . 0.0 111.799 176.495 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -94.75 -116.88 2.92 Favored Glycine 0 N--CA 1.47 0.915 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.573 -173.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.5 m -86.04 74.53 10.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.12 0.962 . . . . 0.0 110.708 -175.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.536 ' C ' ' HZ2' ' A' ' 39' ' ' LYS . . . . . . . . 0 C--O 1.25 1.095 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 41.9 p90 . . . . . 0 N--CA 1.475 0.798 0 CA-C-O 122.345 1.069 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -132.32 -69.84 0.58 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.591 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -78.19 -49.48 13.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.3 t -68.0 -33.66 75.04 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.439 -0.904 . . . . 0.0 113.199 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.06 -30.51 70.59 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.028 -0.669 . . . . 0.0 112.751 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -66.4 -44.34 83.28 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.908 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.58 -50.43 11.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.748 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.25 92.27 0.44 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 120.022 -1.085 . . . . 0.0 110.85 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.99 172.13 42.11 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.954 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -130.87 143.31 50.64 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 m -78.16 128.56 33.97 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.343 1.068 . . . . 0.0 110.967 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -132.14 147.35 65.45 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.441 ' HA ' ' CD1' ' A' ' 34' ' ' TRP . 52.8 Cg_exo -56.98 149.2 63.43 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 121.411 1.407 . . . . 0.0 112.213 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.93 -29.43 69.61 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -64.31 -25.06 67.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -79.06 150.48 31.86 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.481 -0.762 . . . . 0.0 110.374 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -78.42 113.42 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 122.055 0.931 . . . . 0.0 110.643 -173.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 42.5 t -85.43 124.49 32.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 169.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -125.81 116.57 24.39 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.42 163.7 89.69 Favored 'Cis proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.44 -1.483 . . . . 0.0 112.019 5.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.62 -29.82 60.65 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.97 1.78 . . . . 0.0 114.25 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 93.1 p -96.93 50.46 1.1 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.576 -0.703 . . . . 0.0 111.803 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 92.1 p -152.11 78.53 1.23 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.371 1.082 . . . . 0.0 109.626 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.4 p30 -156.84 158.14 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 122.192 0.996 . . . . 0.0 108.827 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.454 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 88.3 m-85 -91.53 174.01 7.59 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 170.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -137.73 5.69 Favored Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.313 -1.422 . . . . 0.0 111.09 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -79.48 97.98 6.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.942 0.877 . . . . 0.0 108.874 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.454 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 61.2 mtp -89.34 -121.4 0.05 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.114 -172.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.54 48.51 1.15 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.369 -0.832 . . . . 0.0 110.808 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 99.8 m -131.53 -93.39 0.39 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -157.54 -176.1 5.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.824 -1.173 . . . . 0.0 112.482 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -60.39 -55.46 33.25 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -90.55 23.36 3.05 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -175.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.441 ' CD1' ' HA ' ' A' ' 13' ' ' PRO . 34.9 m0 -119.93 142.75 48.45 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.099 -1.001 . . . . 0.0 109.474 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -113.88 157.96 21.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.683 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.422 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 4.3 t -100.51 107.13 18.75 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.955 174.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 46.4 t -81.5 142.81 32.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 122.143 0.973 . . . . 0.0 111.095 -172.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -131.2 95.44 3.79 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -82.45 163.93 21.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.542 1.163 . . . . 0.0 113.148 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -107.01 -62.13 0.58 Allowed Glycine 0 CA--C 1.529 0.936 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.38 170.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.0 m -151.58 96.37 2.25 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.646 0.736 . . . . 0.0 109.563 175.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 C-N-CA 120.143 -1.027 . . . . 0.0 110.632 176.517 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 59.5 t80 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.44 -80.32 0.33 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.777 -0.769 . . . . 0.0 110.454 -177.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -78.4 -51.65 9.73 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -171.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.6 t -65.97 -29.96 70.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -76.03 -32.46 59.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.489 -0.757 . . . . 0.0 112.567 175.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -68.39 -45.35 72.93 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.83 -0.544 . . . . 0.0 112.065 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -78.54 -28.44 46.1 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.638 -0.663 . . . . 0.0 112.579 176.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.99 60.83 0.71 Allowed Glycine 0 N--CA 1.468 0.822 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.372 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.6 157.07 17.99 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -107.51 140.01 41.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.11 129.96 35.0 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.631 0.729 . . . . 0.0 111.096 -177.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -141.55 159.83 58.94 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -63.32 144.14 90.66 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 121.736 1.624 . . . . 0.0 112.737 176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -73.9 -55.09 6.6 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.468 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.15 -30.51 70.43 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -92.67 169.66 10.33 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 122.14 0.971 . . . . 0.0 109.968 174.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.6 mt -74.67 124.67 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 121.518 -0.739 . . . . 0.0 111.187 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -100.15 144.44 29.17 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 169.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -119.33 117.82 32.88 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.72 162.65 74.78 Favored 'Cis proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.641 9.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -88.34 -55.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 121.128 1.219 . . . . 0.0 113.398 -169.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 97.3 p -85.6 48.9 1.66 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.601 -0.687 . . . . 0.0 112.574 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 79.0 p -167.81 72.51 0.11 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.434 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 4.6 p30 -134.87 153.7 51.95 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.9 1.333 . . . . 0.0 112.513 -169.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.515 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 73.3 m-85 -94.7 164.31 13.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.938 173.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.29 -138.85 5.76 Favored Glycine 0 N--CA 1.468 0.832 0 C-N-CA 119.987 -1.101 . . . . 0.0 112.029 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -82.22 90.09 6.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.962 0.887 . . . . 0.0 108.892 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.515 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 88.6 mtp -86.01 -86.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -175.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -140.72 50.6 1.66 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 122.052 0.93 . . . . 0.0 109.223 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 85.9 m -98.98 -90.92 0.29 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -150.21 -179.88 7.54 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -57.99 -54.85 42.22 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.826 -1.171 . . . . 0.0 113.332 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -94.96 11.78 30.68 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -105.94 162.84 13.23 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 120.364 -1.46 . . . . 0.0 111.209 -174.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 61.2 pttt -144.12 171.87 13.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.164 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.3 m -104.1 145.93 29.47 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.099 -1.0 . . . . 0.0 110.587 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -130.47 155.68 46.05 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.475 -0.766 . . . . 0.0 109.999 173.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -142.29 143.39 32.79 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.3 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HZ2' ' C ' ' A' ' 42' ' ' GLY . 1.4 pptp? -113.6 -162.1 0.79 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.331 0.586 . . . . 0.0 110.407 171.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.17 -67.59 2.01 Favored Glycine 0 N--CA 1.471 0.986 0 O-C-N 121.193 -0.942 . . . . 0.0 114.026 -174.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 t -90.72 69.1 6.57 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.737 0.78 . . . . 0.0 111.224 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.41 ' C ' ' HZ2' ' A' ' 39' ' ' LYS . . . . . . . . 0 C--O 1.25 1.139 0 CA-C-O 118.449 -1.195 . . . . 0.0 111.756 178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 52.6 p90 . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -95.17 -71.73 0.66 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.146 -0.971 . . . . 0.0 111.609 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.31 -48.33 15.9 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -171.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.31 -39.65 89.46 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -70.54 -37.18 74.03 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -67.73 -43.6 79.58 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.444 -0.785 . . . . 0.0 112.585 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.99 -50.59 40.03 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.951 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.79 72.56 0.07 OUTLIER Glycine 0 N--CA 1.467 0.748 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.933 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.98 152.52 17.48 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 119.533 -1.317 . . . . 0.0 111.484 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -109.23 152.16 25.55 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.751 0.786 . . . . 0.0 109.577 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -79.87 126.18 30.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.17 0.986 . . . . 0.0 111.539 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -130.59 146.56 62.36 Favored Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.22 172.62 2.37 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 121.587 1.525 . . . . 0.0 113.106 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -68.2 -41.25 81.65 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -75.88 -25.49 56.17 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -70.24 138.9 52.06 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 122.084 0.945 . . . . 0.0 110.091 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.8 mt -78.82 120.98 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 122.143 0.973 . . . . 0.0 110.642 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.5 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 43.5 t -85.65 126.3 33.82 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 169.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.27 116.5 30.94 Favored Pre-proline 0 N--CA 1.469 0.496 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -172.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.46 162.44 90.51 Favored 'Cis proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.464 5.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -70.14 -32.05 17.73 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.929 1.752 . . . . 0.0 114.132 -172.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.455 ' C ' ' HG ' ' A' ' 23' ' ' SER . 68.4 m -91.63 60.2 3.96 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.017 175.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.455 ' HG ' ' C ' ' A' ' 22' ' ' SER . 50.5 m -165.99 71.01 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.968 0.89 . . . . 0.0 109.206 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.5 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 3.3 p30 -154.56 151.61 29.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.837 0.827 . . . . 0.0 108.968 178.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -93.02 174.19 7.36 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.601 -0.84 . . . . 0.0 108.901 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.24 -134.79 3.77 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 119.748 -1.215 . . . . 0.0 110.936 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.65 123.76 25.45 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 78.8 mmm -117.98 -95.39 0.48 Allowed 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.249 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -130.55 54.66 1.87 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 122.058 0.932 . . . . 0.0 109.852 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.6 m -144.85 -77.8 0.2 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.161 -0.615 . . . . 0.0 109.62 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -145.46 164.35 31.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.735 0.779 . . . . 0.0 109.539 -173.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -61.62 -49.37 76.85 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -102.31 30.57 4.47 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -114.24 154.37 28.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.121 -0.987 . . . . 0.0 109.051 175.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -114.93 160.57 19.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.913 0.863 . . . . 0.0 111.58 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.72 103.78 13.14 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 44.4 t -79.66 148.61 31.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 122.211 1.005 . . . . 0.0 111.282 -172.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -84.11 111.86 19.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.787 0.803 . . . . 0.0 109.665 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -118.5 -44.48 2.66 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.469 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.59 -97.3 0.13 Allowed Glycine 0 N--CA 1.466 0.646 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.3 t -152.68 79.25 1.21 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.752 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.187 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.806 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 71.2 t80 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -91.65 -72.29 0.59 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.289 -169.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -78.77 -50.19 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -175.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.85 -36.03 81.92 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -75.94 -32.69 59.67 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 112.693 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -66.26 -42.36 88.64 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.73 -0.606 . . . . 0.0 112.072 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -69.33 -48.35 61.67 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.579 -0.849 . . . . 0.0 110.66 171.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.72 92.88 1.41 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -174.52 170.31 43.4 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 118.912 -1.613 . . . . 0.0 112.709 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -131.0 153.63 49.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 99.2 m -79.42 120.49 23.9 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 122.069 0.937 . . . . 0.0 110.992 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -116.81 154.28 49.44 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 171.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -60.97 172.55 2.91 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 121.393 1.395 . . . . 0.0 113.94 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -62.39 -44.78 95.63 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.84 -27.28 69.06 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -174.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -75.55 141.17 43.02 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.295 1.045 . . . . 0.0 111.26 -170.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.1 mt -81.51 133.46 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 121.948 0.88 . . . . 0.0 109.611 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 23' ' ' SER . 35.4 t -84.56 133.07 34.45 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.62 115.17 13.45 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -176.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -74.47 164.33 88.23 Favored 'Cis proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.309 -1.538 . . . . 0.0 111.947 4.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.51 -13.95 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 121.767 1.644 . . . . 0.0 114.48 -171.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 48.2 m -71.22 -24.0 62.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 177.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 69.0 m -100.42 50.02 0.9 Allowed 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.673 -0.642 . . . . 0.0 111.574 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -101.94 100.13 10.39 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.555 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 24.8 m-85 -99.28 159.6 14.88 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.571 -174.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.15 -144.94 2.48 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 119.717 -1.23 . . . . 0.0 112.121 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -82.2 74.72 9.16 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.449 1.119 . . . . 0.0 110.577 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.555 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 95.6 mtp -71.18 -79.61 0.07 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.505 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.05 52.95 0.72 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 169.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.2 m -132.52 173.39 11.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.802 0.811 . . . . 0.0 109.946 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -79.96 -165.78 0.89 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.4 t-105 -52.48 -64.27 0.87 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -101.51 16.58 25.23 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -98.09 160.16 14.48 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.532 -1.355 . . . . 0.0 110.821 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -124.76 141.31 52.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.641 -169.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.35 122.42 30.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.9 t -128.35 144.58 51.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.618 0.723 . . . . 0.0 110.159 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -101.87 102.17 12.71 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.513 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.478 ' HZ2' ' C ' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -81.51 -28.71 33.9 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 178.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -146.74 -102.78 0.32 Allowed Glycine 0 N--CA 1.467 0.744 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 178.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.8 p -86.06 -45.46 11.39 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.861 -0.735 . . . . 0.0 111.425 176.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.478 ' C ' ' HZ2' ' A' ' 39' ' ' LYS . . . . . . . . 0 C--O 1.25 1.096 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 68.9 t80 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -60.15 -55.66 31.11 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.504 -0.748 . . . . 0.0 112.351 -171.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.42 -46.99 18.51 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.995 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.1 t -72.14 -29.15 63.77 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -64.99 -29.14 70.04 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.274 -0.891 . . . . 0.0 112.49 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -55.71 -45.26 77.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.432 -0.507 . . . . 0.0 111.937 173.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -76.88 -45.23 28.94 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.545 -0.722 . . . . 0.0 111.184 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.91 64.94 0.29 Allowed Glycine 0 N--CA 1.469 0.894 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.336 173.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.46 158.44 28.97 Favored Glycine 0 N--CA 1.467 0.761 0 C-N-CA 119.613 -1.279 . . . . 0.0 111.745 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -102.77 158.97 15.88 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.629 0.728 . . . . 0.0 109.759 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.0 m -79.34 138.58 37.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.106 0.955 . . . . 0.0 110.858 177.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.92 159.09 72.46 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -59.24 141.68 98.19 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.78 1.653 . . . . 0.0 113.237 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -72.06 -45.0 62.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.061 -0.655 . . . . 0.0 112.49 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.35 -28.78 67.15 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -174.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -94.36 158.64 15.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.196 0.998 . . . . 0.0 110.349 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.0 mt -83.89 132.67 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-O 121.817 0.817 . . . . 0.0 110.437 -172.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.34 137.57 32.21 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 169.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -115.44 118.57 39.35 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -84.39 161.66 67.75 Favored 'Cis proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.425 -1.489 . . . . 0.0 112.49 8.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -66.63 -39.46 15.76 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.617 1.545 . . . . 0.0 114.391 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 56.0 m -67.62 -36.92 81.74 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 m -85.05 78.63 9.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.76 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -143.09 150.83 40.03 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.414 1.102 . . . . 0.0 110.187 -171.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.616 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 32.5 m-85 -125.95 154.94 42.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.35 -175.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.31 -138.69 4.55 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.285 -172.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.92 85.5 6.21 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 122.018 0.913 . . . . 0.0 109.098 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.616 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 82.7 mtp -84.88 -108.66 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -177.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -108.23 66.8 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 171.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 90.2 m -129.06 -175.65 3.62 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.19 0.995 . . . . 0.0 111.015 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -77.96 170.59 16.34 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.676 0.751 . . . . 0.0 110.669 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -53.53 -55.53 24.75 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 33' ' ' ARG . 38.8 mtm105 -94.52 22.93 5.66 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.577 177.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -116.96 159.6 22.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.535 1.159 . . . . 0.0 109.353 178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -133.85 173.05 11.96 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.776 176.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.407 ' HB3' ' HB2' ' A' ' 25' ' ' PHE . 5.8 t -99.69 155.02 17.84 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.912 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -148.56 150.93 34.2 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.541 -0.864 . . . . 0.0 109.536 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -133.92 117.15 16.43 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.916 0.865 . . . . 0.0 110.089 -179.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -99.32 -72.58 0.66 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 176.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.64 78.15 0.3 Allowed Glycine 0 N--CA 1.468 0.785 0 N-CA-C 108.637 -1.785 . . . . 0.0 108.637 171.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 61.3 m 60.73 61.26 1.72 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.991 0.901 . . . . 0.0 110.79 -170.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -176.49 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 81.1 t80 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -82.87 -86.71 0.1 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.355 -0.841 . . . . 0.0 111.011 -170.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -76.15 -38.75 56.35 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.431 -0.793 . . . . 0.0 112.14 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.4 t -55.41 -37.53 67.76 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -72.18 -39.09 68.93 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.723 -0.611 . . . . 0.0 112.279 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -66.27 -41.35 90.0 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.827 -0.546 . . . . 0.0 112.398 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -66.01 -38.55 88.74 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.423 -0.798 . . . . 0.0 111.656 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.16 83.84 1.7 Allowed Glycine 0 N--CA 1.467 0.734 0 C-N-CA 120.267 -0.968 . . . . 0.0 111.458 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.78 148.31 10.02 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.307 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -83.46 154.82 23.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.596 0.712 . . . . 0.0 109.183 175.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 37.2 m -78.76 125.3 29.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.724 -0.79 . . . . 0.0 110.133 177.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -128.98 148.34 68.56 Favored Pre-proline 0 N--CA 1.468 0.475 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.633 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -56.95 166.9 3.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.934 1.756 . . . . 0.0 113.55 173.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -61.67 -37.83 85.53 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.54 -20.13 66.21 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -176.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -75.69 124.46 27.28 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.381 -0.824 . . . . 0.0 111.106 -175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.3 mt -74.28 137.09 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.091 0.948 . . . . 0.0 109.638 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 33.5 t -88.56 123.95 33.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.0 tp -134.11 125.24 17.91 Favored Pre-proline 0 CA--C 1.538 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -70.46 167.14 73.97 Favored 'Cis proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.048 -1.647 . . . . 0.0 114.165 7.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -66.97 -30.13 39.84 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.702 1.601 . . . . 0.0 114.711 -171.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.6 m -69.35 -43.19 74.12 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -172.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -90.02 73.28 7.35 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.51 -0.744 . . . . 0.0 111.652 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -123.19 132.66 54.14 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -117.85 148.56 42.0 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.37 0.605 . . . . 0.0 109.45 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.64 -124.74 2.04 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.882 -175.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.97 113.12 16.83 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.3 mmm -117.91 -93.18 0.52 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -171.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -138.07 59.95 1.64 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 75.1 m -123.28 -88.93 0.61 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -179.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -159.54 -168.85 2.4 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 62.0 t-105 -61.95 -50.64 71.31 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -173.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -102.13 21.28 15.15 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -118.35 164.39 15.29 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 122.601 1.191 . . . . 0.0 110.304 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -132.81 178.8 6.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.702 -178.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 12.8 m -118.27 145.22 45.21 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.917 0.865 . . . . 0.0 109.752 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.437 ' SG ' ' HD2' ' A' ' 39' ' ' LYS . 42.8 t -141.89 141.36 33.02 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.904 0.859 . . . . 0.0 109.784 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -92.99 89.16 6.41 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.277 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' HD2' ' SG ' ' A' ' 37' ' ' CYS . 14.4 ptmm? -135.69 -56.07 0.78 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.114 -178.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.74 -121.51 0.99 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.648 -1.263 . . . . 0.0 111.265 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -91.9 -48.62 6.67 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.387 -175.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -178.37 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 58.0 t80 . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 120.612 0.244 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -74.08 -57.0 4.26 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.193 -0.942 . . . . 0.0 111.361 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -76.93 -49.02 16.52 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.734 -0.786 . . . . 0.0 112.533 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.9 t -75.13 -31.02 60.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.344 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -68.88 -29.1 67.32 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.366 -0.834 . . . . 0.0 111.958 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -61.61 -39.86 92.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.494 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -75.13 -45.53 40.4 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.38 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.89 91.14 1.37 Allowed Glycine 0 N--CA 1.466 0.639 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.34 -176.24 39.14 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 118.845 -1.645 . . . . 0.0 112.91 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -138.91 145.29 39.68 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.7 m -90.86 143.8 26.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.642 1.21 . . . . 0.0 112.232 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -141.47 158.82 62.63 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.374 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.54 164.13 3.25 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.821 1.681 . . . . 0.0 113.493 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.17 -22.57 62.95 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.57 -24.45 39.19 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -176.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -74.43 142.92 44.92 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.98 0.895 . . . . 0.0 110.821 -176.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.8 mt -82.0 131.81 32.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.92 0.867 . . . . 0.0 109.676 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 95.8 m -98.33 102.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 169.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.5 tp -110.38 133.61 21.05 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 163.31 86.11 Favored 'Cis proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.383 5.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -69.92 -24.33 29.07 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.645 1.563 . . . . 0.0 113.599 -171.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p -87.62 49.44 1.81 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 122.056 0.932 . . . . 0.0 110.49 174.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 t -150.91 51.4 0.86 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' SG ' ' A' ' 37' ' ' CYS . 32.3 t70 -140.64 129.19 22.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.652 0.739 . . . . 0.0 109.291 -171.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -116.21 162.12 17.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.9 -145.56 5.9 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 119.231 -1.461 . . . . 0.0 111.546 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -78.81 101.72 7.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.268 1.032 . . . . 0.0 108.952 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.439 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 90.9 mtp -96.92 -118.81 0.12 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -96.81 62.77 1.93 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.0 0.905 . . . . 0.0 108.719 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 50.3 m -146.92 -160.97 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.519 0.676 . . . . 0.0 110.301 -174.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -71.21 157.17 38.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.185 0.993 . . . . 0.0 110.913 -174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -56.79 -50.22 72.99 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.68 12.1 31.02 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.858 -177.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -108.82 172.0 7.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.378 -0.826 . . . . 0.0 108.868 175.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -139.59 173.82 11.14 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.626 -0.829 . . . . 0.0 110.591 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.439 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.8 t -109.44 153.08 24.53 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.557 -177.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 89.2 m -139.43 157.79 45.25 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -80.69 80.31 7.17 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.997 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -127.5 166.41 18.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.329 1.061 . . . . 0.0 109.967 177.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -98.82 -62.77 0.85 Allowed Glycine 0 N--CA 1.466 0.692 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 169.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.6 p -147.86 72.04 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.784 -0.766 . . . . 0.0 109.85 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.479 -1.343 . . . . 0.0 111.094 178.116 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.0 p90 . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 121.817 0.818 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -156.07 -58.15 0.09 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 118.983 -1.087 . . . . 0.0 111.757 -172.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -74.11 -60.59 2.19 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.636 -0.826 . . . . 0.0 112.372 -170.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.4 ' HB2' ' CB ' ' A' ' 28' ' ' MET . 4.6 t -78.37 -36.3 46.21 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.994 -1.066 . . . . 0.0 112.318 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -65.82 -37.37 86.07 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.061 -0.656 . . . . 0.0 112.404 -174.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -78.96 -29.82 44.17 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.065 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -79.36 -59.68 2.66 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.258 -0.902 . . . . 0.0 110.254 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.09 90.6 0.15 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 119.724 -1.227 . . . . 0.0 111.245 176.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.69 -177.13 40.5 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 119.017 -1.563 . . . . 0.0 112.68 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -138.17 150.35 46.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m -82.1 136.95 35.11 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 122.117 0.96 . . . . 0.0 112.354 -176.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -139.04 147.34 53.31 Favored Pre-proline 0 N--CA 1.467 0.398 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.9 148.21 48.01 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 121.729 1.619 . . . . 0.0 112.338 173.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -70.48 -45.05 66.45 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.553 -174.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.19 -33.58 74.81 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.31 147.89 29.66 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.974 0.893 . . . . 0.0 109.835 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -86.78 133.79 29.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.221 1.01 . . . . 0.0 111.303 -169.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.9 m -77.61 133.68 38.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.353 170.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.26 113.95 13.5 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -176.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.89 159.09 80.23 Favored 'Cis proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.184 -1.59 . . . . 0.0 112.627 10.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -93.9 48.52 0.31 Allowed 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 121.58 1.52 . . . . 0.0 111.123 -173.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -74.62 -41.35 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.172 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -149.3 120.13 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.625 -0.83 . . . . 0.0 109.864 -173.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -114.85 104.51 12.02 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.89 0.852 . . . . 0.0 109.536 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.701 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 63.6 m-85 -79.2 162.94 25.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.065 0.936 . . . . 0.0 110.354 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.2 -126.99 5.27 Favored Glycine 0 N--CA 1.465 0.602 0 C-N-CA 119.64 -1.267 . . . . 0.0 111.741 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -82.12 96.82 7.91 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.004 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.701 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 71.2 mtp -108.36 -116.01 0.28 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -177.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.437 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 60.8 m-20 -91.11 53.51 2.37 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.129 169.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.5 m -135.55 171.98 13.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.998 0.904 . . . . 0.0 110.78 -173.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -64.56 166.14 9.0 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.654 0.74 . . . . 0.0 110.541 179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.5 t-105 -55.17 -51.96 64.85 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -174.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -96.03 24.29 5.69 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.463 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -111.23 -174.37 2.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 122.115 0.96 . . . . 0.0 108.811 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -150.2 166.99 28.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.24 -172.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.584 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 1.8 t -111.47 140.53 45.99 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.194 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.5 m -121.11 152.46 38.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.16 0.981 . . . . 0.0 110.588 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -148.86 131.5 15.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.31 -0.859 . . . . 0.0 108.831 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -80.05 172.82 13.27 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.589 174.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 118.15 -169.08 13.23 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 119.751 -1.214 . . . . 0.0 112.441 173.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 88.5 p -91.14 53.33 2.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.704 -0.748 . . . . 0.0 111.452 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.112 0 C-N-CA 119.996 -1.097 . . . . 0.0 110.785 -179.467 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 89.8 t80 . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 120.382 0.134 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.0 tptm -99.41 -62.1 1.28 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.476 -0.89 . . . . 0.0 111.934 -170.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.56 -59.97 2.56 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.252 -170.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.501 ' H ' ' HB2' ' A' ' 29' ' ' ASP . 14.1 t -77.37 -30.75 53.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.968 -172.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.41 -34.87 78.67 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.594 -0.691 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -70.25 -41.04 74.03 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.762 177.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -74.79 -57.86 3.65 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.992 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.53 84.67 0.07 OUTLIER Glycine 0 N--CA 1.465 0.595 0 C-N-CA 119.837 -1.173 . . . . 0.0 110.466 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.67 169.21 39.06 Favored Glycine 0 CA--C 1.525 0.694 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.542 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -128.56 128.11 43.63 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 36' ' ' CYS . 48.7 t -80.81 136.15 36.07 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.321 1.058 . . . . 0.0 111.796 -175.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -138.51 158.41 70.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.81 -1.087 . . . . 0.0 108.202 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HA ' ' CG ' ' A' ' 34' ' ' TRP . 54.5 Cg_exo -61.72 178.46 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 121.442 1.428 . . . . 0.0 114.123 -179.177 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -61.8 -44.94 95.87 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.431 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -63.55 -26.5 68.73 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -76.05 133.01 40.46 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.507 -173.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.1 mt -81.3 131.12 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.913 0.864 . . . . 0.0 110.051 -175.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -86.42 134.54 33.69 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -133.7 113.76 12.99 Favored Pre-proline 0 C--N 1.325 -0.491 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -177.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.19 160.69 96.04 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 123.397 -1.501 . . . . 0.0 112.239 5.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.37 -26.66 10.14 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 121.837 1.692 . . . . 0.0 113.268 -174.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 84.6 p -71.23 -24.92 62.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.436 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.7 m -91.99 71.49 5.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.825 0.821 . . . . 0.0 109.851 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -142.81 119.57 11.18 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.52 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 71.6 m-85 -83.81 176.32 9.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.796 177.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.39 -133.4 5.82 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 119.422 -1.371 . . . . 0.0 110.718 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -76.4 117.34 17.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.416 -0.913 . . . . 0.0 108.877 176.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.52 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 82.9 mtp -122.44 -106.3 0.36 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.625 -175.055 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HB2' ' H ' ' A' ' 4' ' ' CYS . 15.5 t70 -95.4 50.67 1.26 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.545 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 p -157.47 -89.2 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.323 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -159.64 -173.39 4.11 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.643 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 18.3 t-105 -54.94 -62.46 1.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -83.71 1.55 42.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.484 -0.886 . . . . 0.0 112.927 -170.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.435 ' CG ' ' HA ' ' A' ' 13' ' ' PRO . 34.5 m0 -97.11 150.05 21.28 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.231 -0.918 . . . . 0.0 109.157 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.38 159.46 24.16 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.977 -174.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.448 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 8.8 t -111.24 116.2 30.63 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.257 175.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.28 126.68 33.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.851 0.834 . . . . 0.0 110.209 -175.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.05 121.95 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.882 0.849 . . . . 0.0 109.028 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -154.86 -50.68 0.09 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.075 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.89 -94.11 0.15 Allowed Glycine 0 N--CA 1.465 0.57 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -178.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.5 p -132.34 83.54 2.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.961 0.886 . . . . 0.0 110.131 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 C-N-CA 119.625 -1.274 . . . . 0.0 110.757 177.678 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 57.9 t80 . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.675 0.274 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -82.33 -68.84 0.67 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.441 -0.787 . . . . 0.0 109.827 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -77.35 -43.66 32.16 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.073 -177.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.47 ' SG ' ' SD ' ' A' ' 28' ' ' MET . 14.1 t -72.13 -29.1 63.73 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 119.237 -0.985 . . . . 0.0 113.553 -173.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -69.45 -31.67 70.13 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.329 -0.948 . . . . 0.0 111.404 176.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -66.15 -38.36 87.91 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.341 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -74.78 -49.18 21.77 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.271 175.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.89 80.31 0.46 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.69 169.58 42.07 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 119.023 -1.56 . . . . 0.0 112.757 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -118.99 150.22 40.31 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.6 m -80.46 137.42 36.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.198 0.999 . . . . 0.0 111.329 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -133.75 137.67 29.19 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.54 165.96 8.71 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 C-N-CA 121.548 1.499 . . . . 0.0 112.344 175.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -77.77 86.07 4.05 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.98 0.895 . . . . 0.0 109.602 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.402 ' HG3' ' HG3' ' A' ' 16' ' ' LYS . 13.4 pt-20 -150.19 -27.74 0.24 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.263 -176.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.402 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 25.2 mtpp -127.54 169.66 13.46 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.993 1.378 . . . . 0.0 112.533 -171.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.0 mt -77.95 137.17 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.3 t -86.54 117.32 25.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -137.13 114.27 9.83 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -169.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -70.23 164.62 80.11 Favored 'Cis proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.967 -1.68 . . . . 0.0 113.674 8.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -85.12 -24.26 2.14 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.588 1.526 . . . . 0.0 113.512 -169.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 85.9 p -66.59 -26.86 67.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.328 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -94.61 47.4 1.17 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.001 -0.68 . . . . 0.0 111.557 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -108.07 102.99 12.11 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.469 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 89.8 m-85 -79.61 161.03 26.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.3 -131.54 5.15 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 119.055 -1.545 . . . . 0.0 111.316 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -82.45 99.38 9.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.536 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 70.6 mtp -93.04 -112.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.131 -173.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.52 33.39 4.55 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.137 -0.977 . . . . 0.0 111.921 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 58.7 m -111.35 -83.24 0.58 Allowed 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.292 -178.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.7 ptp180 -158.38 -175.37 5.29 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 118.532 -1.267 . . . . 0.0 111.299 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -63.35 -48.7 76.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.947 -1.024 . . . . 0.0 113.016 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -97.44 23.68 7.37 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.435 -0.906 . . . . 0.0 113.113 -175.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -117.56 152.31 35.37 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.061 -1.024 . . . . 0.0 109.587 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -110.7 166.94 10.61 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.536 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 17.0 t -120.64 127.84 52.45 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 169.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.49 ' SG ' ' HG3' ' A' ' 39' ' ' LYS . 47.2 t -130.05 154.01 47.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.573 0.701 . . . . 0.0 109.617 -173.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -104.55 74.88 1.19 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.114 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.49 ' HG3' ' SG ' ' A' ' 37' ' ' CYS . 1.9 pptp? -160.46 170.31 21.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.027 0.918 . . . . 0.0 110.733 176.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -109.63 -83.19 1.43 Allowed Glycine 0 N--CA 1.467 0.724 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.017 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.1 m -93.43 86.47 5.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.875 0.845 . . . . 0.0 110.055 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 177.182 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.7 t80 . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 120.578 0.228 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.89 -38.34 64.41 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.429 -0.908 . . . . 0.0 113.298 -170.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.08 -47.73 17.65 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.17 -0.956 . . . . 0.0 111.505 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.61 -36.8 70.91 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -173.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -76.71 -42.98 39.35 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.359 -0.838 . . . . 0.0 111.621 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -62.98 -43.45 98.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.048 -0.661 . . . . 0.0 112.445 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -68.7 -33.63 74.29 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.761 -0.776 . . . . 0.0 112.322 -178.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.62 92.89 1.22 Allowed Glycine 0 N--CA 1.465 0.599 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.82 170.84 31.28 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 119.233 -1.461 . . . . 0.0 111.662 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.26 144.01 38.21 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -79.7 132.98 36.34 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.976 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -140.13 157.08 69.78 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -51.36 142.61 37.14 Favored 'Trans proline' 0 CA--C 1.53 0.304 0 C-N-CA 121.507 1.472 . . . . 0.0 110.547 169.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.83 -14.35 61.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -92.76 -20.5 20.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -90.25 -106.49 0.09 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.112 -169.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.8 mt -115.81 132.51 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 122.758 1.266 . . . . 0.0 111.309 -173.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 t -132.99 123.59 26.16 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.265 -2.494 . . . . 0.0 104.265 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -118.35 117.13 34.96 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -76.52 165.24 85.73 Favored 'Cis proline' 0 CA--C 1.534 0.518 0 C-N-CA 123.131 -1.612 . . . . 0.0 111.815 6.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -49.36 -65.21 0.17 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.31 2.007 . . . . 0.0 116.058 -168.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.7 m -97.75 65.23 1.82 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.063 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.2 m -154.17 108.83 3.06 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.396 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 1.8 p30 -160.76 149.22 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.373 1.082 . . . . 0.0 111.798 -176.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.439 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 99.0 m-85 -84.41 164.62 18.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.49 -140.98 2.21 Favored Glycine 0 N--CA 1.466 0.663 0 C-N-CA 119.552 -1.308 . . . . 0.0 111.806 -172.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -80.59 100.0 8.4 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 122.736 1.255 . . . . 0.0 108.357 176.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.635 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 93.7 mtp -90.2 -81.24 0.3 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.633 -172.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -148.06 57.84 1.09 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 119.548 -0.861 . . . . 0.0 110.713 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.3 m -135.13 -102.15 0.22 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.852 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -135.81 166.78 22.49 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.456 -0.777 . . . . 0.0 109.331 -172.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -57.51 -60.19 4.03 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -85.77 14.35 6.01 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.704 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.0 m0 -111.7 132.19 54.79 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.128 -0.983 . . . . 0.0 108.685 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.435 ' HZ2' ' CG ' ' A' ' 24' ' ' ASP . 22.0 pttp -115.18 158.74 21.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.894 0.854 . . . . 0.0 110.431 179.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.635 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 44.7 t -91.83 115.21 27.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -78.77 148.3 33.03 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.804 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -96.08 151.28 19.61 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.383 0.611 . . . . 0.0 110.973 -171.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.443 ' HD3' ' H ' ' A' ' 40' ' ' GLY . 0.0 OUTLIER -91.25 -49.98 6.07 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.69 176.446 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.443 ' H ' ' HD3' ' A' ' 39' ' ' LYS . . . 164.72 -69.37 0.2 Allowed Glycine 0 N--CA 1.466 0.696 0 C-N-CA 119.501 -1.333 . . . . 0.0 111.725 -177.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 90.4 p -81.67 80.85 7.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.99 0.9 . . . . 0.0 110.752 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.173 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 -178.251 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.414 ' O ' ' HB3' ' A' ' 5' ' ' HIS . 74.8 t80 . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 120.668 0.27 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 tptt -85.95 -37.38 19.1 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 119.034 -1.067 . . . . 0.0 111.985 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.6 -61.61 1.94 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.814 -0.754 . . . . 0.0 112.412 -172.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.587 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 72.4 m -78.59 -33.94 47.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.189 -1.004 . . . . 0.0 113.391 -174.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 1' ' ' TYR . 48.4 t-80 -72.31 -41.42 66.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.192 -0.943 . . . . 0.0 112.867 -173.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -65.55 -34.62 78.68 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.551 178.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -74.44 -47.86 31.06 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.455 173.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.11 69.17 0.18 Allowed Glycine 0 N--CA 1.465 0.593 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.991 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.47 -178.06 33.13 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 119.342 -1.408 . . . . 0.0 111.853 -177.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -155.51 158.93 39.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.9 m -78.81 120.27 23.2 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.338 -176.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.423 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 92.0 m-85 -120.02 152.3 54.0 Favored Pre-proline 0 N--CA 1.469 0.509 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.428 ' HA ' ' CD1' ' A' ' 34' ' ' TRP . 46.6 Cg_exo -69.52 153.29 70.21 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 121.37 1.38 . . . . 0.0 113.03 -175.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -68.89 -25.35 64.56 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.67 -26.46 66.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -91.54 137.26 32.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.748 0.785 . . . . 0.0 109.598 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.7 mt -85.93 124.78 40.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.778 -174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.1 t -93.77 138.46 31.93 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -125.46 122.87 24.99 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -171.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -81.0 165.99 75.23 Favored 'Cis proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.398 -1.501 . . . . 0.0 112.57 7.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.72 -12.39 15.03 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 121.723 1.615 . . . . 0.0 113.548 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.1 t -102.8 45.27 0.97 Allowed 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.452 -0.78 . . . . 0.0 111.512 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.0 p -160.55 63.73 0.32 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.862 0.839 . . . . 0.0 109.52 177.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -153.43 135.57 14.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.157 0.98 . . . . 0.0 109.114 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.715 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 82.7 m-85 -92.21 168.24 11.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.786 0.803 . . . . 0.0 109.4 179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.12 -116.05 2.68 Favored Glycine 0 N--CA 1.466 0.649 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.025 -174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -86.22 78.83 9.27 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.286 -0.965 . . . . 0.0 109.56 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.715 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.2 mtp -78.72 -85.28 0.08 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.8 p30 -120.94 40.52 3.53 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.045 0.926 . . . . 0.0 109.141 169.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 70.9 m -111.91 178.46 4.31 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.861 0.839 . . . . 0.0 110.557 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -95.35 -168.48 1.8 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.104 0.954 . . . . 0.0 111.24 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -55.69 -60.3 3.64 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -80.68 -6.01 57.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.428 ' CD1' ' HA ' ' A' ' 13' ' ' PRO . 42.4 m0 -111.38 163.54 13.89 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.853 -1.155 . . . . 0.0 110.509 -172.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -147.64 166.67 26.71 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 57.8 m -94.0 120.25 33.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.059 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 t -97.02 142.76 28.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.955 174.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HZ2' ' C ' ' A' ' 42' ' ' GLY . 28.2 ttpp -113.38 103.96 11.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.546 0.689 . . . . 0.0 109.208 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -26.35 29.57 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.67 75.5 0.05 OUTLIER Glycine 0 CA--C 1.525 0.683 0 C-N-CA 119.425 -1.369 . . . . 0.0 111.487 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.1 t -163.77 72.96 0.28 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.436 ' C ' ' HZ2' ' A' ' 38' ' ' LYS . . . . . . . . 0 C--O 1.251 1.182 0 C-N-CA 119.704 -1.236 . . . . 0.0 110.286 -174.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 52.0 p90 . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -95.01 -66.41 0.91 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -172.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -77.77 -51.47 10.48 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 119.848 -0.741 . . . . 0.0 112.016 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.7 t -58.87 -40.52 84.6 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -176.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -77.93 -39.04 44.08 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 119.503 -0.879 . . . . 0.0 112.444 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -72.56 -35.07 67.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.369 -0.832 . . . . 0.0 112.41 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -65.04 -42.96 93.84 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.51 -0.744 . . . . 0.0 111.499 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.84 76.53 0.15 Allowed Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.884 -1.151 . . . . 0.0 110.527 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -179.73 -179.16 48.76 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 118.897 -1.62 . . . . 0.0 112.125 -177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -136.43 144.23 44.33 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.7 t -79.72 132.86 36.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.27 1.033 . . . . 0.0 111.836 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.25 153.19 70.9 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -56.88 168.87 2.15 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 121.647 1.565 . . . . 0.0 112.905 175.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -80.28 -9.31 59.73 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.25 47.27 2.42 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.2 1.0 . . . . 0.0 111.915 -172.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -145.14 175.04 10.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.94 0.876 . . . . 0.0 110.255 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -90.74 122.85 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.734 0.778 . . . . 0.0 110.337 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.5 p -123.47 152.85 41.27 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.04 116.87 51.06 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -84.67 159.87 67.18 Favored 'Cis proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.297 -1.543 . . . . 0.0 112.05 9.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.412 ' HG2' ' H ' ' A' ' 22' ' ' SER . 64.8 Cg_endo -82.73 -57.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 121.361 1.374 . . . . 0.0 112.781 -171.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.412 ' H ' ' HG2' ' A' ' 21' ' ' PRO . 38.8 m -92.98 58.69 3.01 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.374 -173.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 t -164.2 88.19 0.51 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.77 159.38 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.61 1.195 . . . . 0.0 111.875 -173.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.531 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 80.8 m-85 -97.71 179.22 4.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.497 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.07 -130.46 5.79 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 119.526 -1.321 . . . . 0.0 110.699 -176.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -81.93 109.08 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 118.954 -1.098 . . . . 0.0 108.787 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.612 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.3 mtp -107.45 -121.1 0.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.24 66.05 1.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.6 t -146.55 -142.25 0.13 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -83.41 160.6 21.56 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 120.943 -1.098 . . . . 0.0 109.997 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.3 t-105 -55.43 -38.1 68.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -110.45 14.15 22.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -104.89 151.85 23.35 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.036 -1.04 . . . . 0.0 109.867 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HB2' ' HZ3' ' A' ' 35' ' ' LYS . 10.5 mtmp? -110.3 165.81 11.47 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.067 0.937 . . . . 0.0 110.992 -175.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.612 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 50.3 t -114.66 113.14 23.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -177.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 93.1 m -78.34 144.7 35.8 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.423 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -90.54 120.94 32.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.732 0.777 . . . . 0.0 110.337 -173.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -130.81 -71.51 0.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.91 0.862 . . . . 0.0 109.715 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 135.23 63.04 0.06 OUTLIER Glycine 0 CA--C 1.526 0.72 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -171.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.2 t 66.23 88.71 0.11 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.834 0.826 . . . . 0.0 111.362 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.25 0 C-N-CA 119.392 -1.385 . . . . 0.0 110.756 179.741 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 69.4 t80 . . . . . 0 N--CA 1.475 0.79 0 CA-C-O 120.737 0.303 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -90.47 -66.01 0.96 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.456 -177.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -78.24 -50.74 11.31 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 119.696 -0.801 . . . . 0.0 112.411 -174.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.696 ' SG ' ' CB ' ' A' ' 28' ' ' MET . 86.5 m -62.96 -30.48 71.61 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.644 -0.822 . . . . 0.0 113.183 -177.604 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -72.13 -31.15 65.73 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.791 -0.764 . . . . 0.0 112.342 -179.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -71.55 -42.57 67.71 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.521 -0.737 . . . . 0.0 111.648 176.85 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.16 -44.9 59.31 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.447 -179.521 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.69 70.89 0.3 Allowed Glycine 0 N--CA 1.465 0.6 0 C-N-CA 120.031 -1.081 . . . . 0.0 110.406 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.32 159.32 30.35 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 119.627 -1.273 . . . . 0.0 110.534 -179.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -112.4 145.53 39.97 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 9.0 m -79.33 134.2 36.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.206 1.003 . . . . 0.0 110.873 179.335 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -142.5 154.57 63.58 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 176.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.07 161.51 2.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 121.648 1.565 . . . . 0.0 112.79 172.101 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -62.19 -29.48 70.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -178.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.58 -25.26 63.89 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.551 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -87.2 135.66 33.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.188 0.994 . . . . 0.0 110.728 -171.033 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -128.55 130.84 69.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.911 -176.894 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 29.2 p -91.91 101.85 14.42 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 170.414 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.7 tp -70.7 138.28 85.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.312 -172.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -85.04 168.08 52.62 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 123.647 -1.397 . . . . 0.0 112.618 8.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -93.19 52.27 0.41 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 121.333 1.355 . . . . 0.0 111.649 -169.734 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.7 t -92.37 -59.4 2.09 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.981 -174.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -100.19 82.31 2.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.01 0.909 . . . . 0.0 109.386 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -109.82 103.79 12.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 35' ' ' LYS . 52.5 m-85 -82.04 158.25 23.86 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.842 -0.743 . . . . 0.0 109.713 -177.868 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.3 -137.37 5.76 Favored Glycine 0 N--CA 1.468 0.792 0 C-N-CA 119.779 -1.201 . . . . 0.0 111.695 -174.393 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -76.01 104.89 6.76 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.355 1.074 . . . . 0.0 108.959 176.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.696 ' CB ' ' SG ' ' A' ' 4' ' ' CYS . 66.7 mmm -95.58 -76.36 0.5 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.844 -172.799 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -153.41 58.74 0.76 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.9 0.857 . . . . 0.0 110.1 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.5 m -141.45 -71.23 0.35 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.7 -175.556 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -151.26 165.55 33.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.866 0.841 . . . . 0.0 109.544 -177.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -60.48 -48.56 81.22 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -177.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -100.5 13.62 34.0 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.736 -0.785 . . . . 0.0 112.991 -177.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -108.27 165.81 11.22 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -146.73 174.9 11.04 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -175.558 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 99.1 m -110.29 123.74 50.37 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.612 176.707 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 18' ' ' CYS . 45.1 t -104.96 149.67 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.117 0.961 . . . . 0.0 110.508 -177.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -149.15 130.45 14.65 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -176.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -74.98 -135.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.989 -0.685 . . . . 0.0 110.71 -175.033 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.67 -73.73 0.06 OUTLIER Glycine 0 CA--C 1.525 0.656 0 C-N-CA 119.498 -1.334 . . . . 0.0 111.274 -176.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -82.47 -62.29 1.65 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.158 -176.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.483 -1.176 . . . . 0.0 110.818 -178.76 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 64.2 t80 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 121.267 0.556 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -174.27 -69.76 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.982 170.044 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -78.99 -50.56 10.91 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.838 -172.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.8 t -70.94 -32.88 69.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 119.087 -1.045 . . . . 0.0 112.629 -172.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -67.52 -36.31 80.78 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.079 178.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.55 -42.7 95.54 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.573 179.012 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -72.46 -45.63 58.63 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.325 177.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 124.11 77.79 0.35 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.594 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.58 174.31 38.94 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 119.262 -1.447 . . . . 0.0 111.91 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -141.25 154.56 45.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.165 0.983 . . . . 0.0 109.655 -178.601 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.6 t -79.09 123.89 27.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.936 0.874 . . . . 0.0 111.39 -175.622 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -136.45 159.27 71.26 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.145 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.66 149.02 51.42 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.788 1.659 . . . . 0.0 112.678 177.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -73.08 -52.04 15.8 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.927 -176.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.84 -26.28 68.26 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -176.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -77.06 147.03 36.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.972 0.891 . . . . 0.0 110.722 -178.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.3 mt -71.16 135.7 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 122.214 1.007 . . . . 0.0 110.938 -177.049 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.7 t -95.0 116.3 28.52 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 168.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -124.43 117.42 26.56 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -172.512 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.19 159.29 93.04 Favored 'Cis proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.298 -1.542 . . . . 0.0 111.949 6.086 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -94.58 55.63 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 121.532 1.488 . . . . 0.0 111.56 -169.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.3 p -67.94 -64.01 0.95 Allowed 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.767 -0.773 . . . . 0.0 112.305 -173.116 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.1 m -144.18 112.72 6.55 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 119.359 -0.937 . . . . 0.0 110.465 -179.364 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -98.35 118.36 34.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.08 0.943 . . . . 0.0 109.347 175.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.67 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 78.0 m-85 -92.3 165.85 12.89 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.606 178.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -77.91 -134.48 0.78 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 119.599 -1.286 . . . . 0.0 111.832 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -84.47 90.38 7.6 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.507 178.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.67 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 84.2 mtp -95.34 -115.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.459 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -91.36 75.52 6.03 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 171.348 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.7 t -148.2 168.21 23.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.074 -1.051 . . . . 0.0 110.986 -170.013 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.454 ' HG2' ' H ' ' A' ' 32' ' ' TRP . 70.0 ttt180 -73.6 178.07 4.96 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.537 0.684 . . . . 0.0 110.627 -175.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.454 ' H ' ' HG2' ' A' ' 31' ' ' ARG . 59.1 t-105 -55.79 -60.75 3.01 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.492 -0.755 . . . . 0.0 112.826 -172.14 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -95.44 24.03 5.48 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.6 -0.84 . . . . 0.0 112.432 178.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.3 m0 -112.28 163.46 14.36 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.138 -0.976 . . . . 0.0 110.024 -177.414 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -125.64 168.28 13.94 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.987 -178.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 t -106.79 133.09 51.98 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.326 176.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 49.7 t -120.49 145.3 47.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 122.178 0.99 . . . . 0.0 112.083 -173.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -96.09 152.76 18.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.999 173.581 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HZ2' ' C ' ' A' ' 42' ' ' GLY . 0.0 OUTLIER -85.64 -175.99 5.87 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.48 176.445 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.36 -113.83 3.86 Favored Glycine 0 N--CA 1.466 0.673 0 C-N-CA 119.579 -1.296 . . . . 0.0 111.956 -172.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -91.22 79.15 5.73 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.087 0.946 . . . . 0.0 110.119 -175.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.424 ' C ' ' HZ2' ' A' ' 39' ' ' LYS . . . . . . . . 0 C--O 1.249 1.064 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 31.2 p90 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 122.1 0.952 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -135.16 -70.16 0.49 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.777 -178.675 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -72.06 -50.57 27.24 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.758 -177.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.5 t -77.18 -29.45 54.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.652 -0.819 . . . . 0.0 112.276 -176.48 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -68.16 -36.07 79.06 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.803 -0.759 . . . . 0.0 111.524 175.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -66.22 -42.66 88.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.478 177.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.97 -49.58 50.27 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.011 174.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.82 85.24 0.58 Allowed Glycine 0 N--CA 1.465 0.629 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.3 -176.52 39.87 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.541 -1.314 . . . . 0.0 111.314 -178.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -143.82 138.0 28.38 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.66 -0.816 . . . . 0.0 109.377 -178.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.5 m -80.14 135.01 36.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.451 1.12 . . . . 0.0 111.149 179.146 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -129.22 145.57 57.26 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.056 175.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HA ' ' CD1' ' A' ' 34' ' ' TRP . 58.7 Cg_exo -56.37 166.16 3.69 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.686 1.591 . . . . 0.0 113.208 177.389 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -59.41 -45.46 91.48 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.675 178.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.84 -27.15 69.13 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -175.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -86.97 134.49 33.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.132 0.967 . . . . 0.0 110.369 -172.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.4 mt -112.58 124.97 69.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.001 -171.659 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.4 p -94.33 137.06 33.93 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 168.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.83 120.58 55.23 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -86.02 159.01 57.77 Favored 'Cis proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.236 -1.568 . . . . 0.0 112.219 9.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.81 -27.04 4.18 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 121.743 1.629 . . . . 0.0 113.198 -173.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.441 ' C ' ' HG ' ' A' ' 23' ' ' SER . 95.7 p -85.28 59.57 5.71 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.478 -0.764 . . . . 0.0 110.763 -179.462 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.441 ' HG ' ' C ' ' A' ' 22' ' ' SER . 64.7 m -162.44 80.73 0.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.399 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -158.59 147.33 18.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.124 0.964 . . . . 0.0 110.595 -175.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.504 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 84.4 m-85 -82.05 160.23 23.27 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.481 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -121.4 0.6 Allowed Glycine 0 N--CA 1.465 0.606 0 C-N-CA 119.244 -1.455 . . . . 0.0 110.754 -175.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -88.29 95.89 10.36 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.445 -0.902 . . . . 0.0 108.63 177.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.504 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.9 mtp -86.98 -108.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.53 50.61 0.8 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.96 0.886 . . . . 0.0 110.109 174.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.2 m -141.41 177.97 7.75 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -177.354 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -74.02 -178.85 3.48 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.272 1.034 . . . . 0.0 112.228 -171.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -57.17 -52.58 64.73 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -172.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -89.82 -3.26 58.22 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.566 -0.854 . . . . 0.0 113.104 -171.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.419 ' CD1' ' HA ' ' A' ' 13' ' ' PRO . 36.4 m0 -99.59 147.11 25.71 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.817 -1.177 . . . . 0.0 109.469 -178.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -124.43 155.57 38.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -174.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.469 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 6.5 t -99.54 114.14 26.96 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.922 -1.111 . . . . 0.0 109.762 176.881 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.1 t -86.45 144.56 27.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.241 1.019 . . . . 0.0 111.171 -174.202 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -156.85 119.59 4.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -80.63 171.45 15.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.539 1.161 . . . . 0.0 112.333 -175.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -94.79 -64.68 1.0 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 169.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.8 t -154.58 96.15 1.86 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.893 -0.723 . . . . 0.0 109.181 177.117 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 C-N-CA 119.671 -1.252 . . . . 0.0 110.736 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 73.3 t80 . . . . . 0 N--CA 1.472 0.658 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -142.21 -137.68 0.11 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 119.704 -0.799 . . . . 0.0 109.247 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -75.12 -49.26 20.15 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.195 -0.94 . . . . 0.0 112.771 -170.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.583 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 83.7 m -62.46 -32.79 73.72 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.294 -0.878 . . . . 0.0 112.206 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -71.88 -29.86 64.8 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.163 -0.615 . . . . 0.0 112.375 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -66.11 -43.3 87.6 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.59 -0.694 . . . . 0.0 111.732 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -72.9 -36.33 67.27 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 119.499 -0.88 . . . . 0.0 111.579 176.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.42 57.35 0.29 Allowed Glycine 0 N--CA 1.467 0.761 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.509 175.299 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -158.02 -170.59 22.94 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 119.632 -1.27 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -142.41 161.0 39.16 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.123 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 88.1 m -79.82 144.1 33.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.089 0.947 . . . . 0.0 111.087 175.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -135.26 145.55 54.45 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.036 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.2 153.91 55.72 Favored 'Trans proline' 0 C--N 1.332 -0.29 0 C-N-CA 121.556 1.504 . . . . 0.0 112.284 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -84.13 79.99 9.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.243 1.02 . . . . 0.0 110.205 -176.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -154.23 -35.84 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.773 178.495 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -93.24 156.2 16.97 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.887 0.851 . . . . 0.0 109.69 177.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.9 mt -87.13 130.65 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.096 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.2 t -86.8 131.31 34.16 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.676 173.127 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -122.96 119.81 27.75 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -173.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.84 161.06 83.2 Favored 'Cis proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.423 -1.49 . . . . 0.0 111.951 6.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -80.07 -7.96 14.22 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 121.69 1.594 . . . . 0.0 113.499 -176.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -71.51 -42.82 67.51 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.443 -0.786 . . . . 0.0 111.794 -178.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -88.56 65.75 7.94 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 122.309 1.052 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -118.41 120.1 36.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.584 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.8 m-85 -102.6 153.09 20.44 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.746 -0.782 . . . . 0.0 109.473 -175.51 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.98 -118.86 2.15 Favored Glycine 0 N--CA 1.466 0.639 0 C-N-CA 119.391 -1.385 . . . . 0.0 111.419 -171.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -83.37 81.54 8.67 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.178 178.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.584 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 86.6 mtp -83.37 -71.52 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.083 -179.716 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.449 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 35.3 t70 -126.9 31.48 5.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.571 0.701 . . . . 0.0 109.813 178.216 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 95.0 m -150.66 178.4 9.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 122.185 0.993 . . . . 0.0 110.86 -171.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -77.8 -175.44 3.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 122.253 1.025 . . . . 0.0 112.162 -171.857 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.1 t-105 -63.36 -51.43 65.93 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.379 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.39 6.52 11.96 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.888 -175.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 14.2 m0 -121.31 156.72 31.96 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -142.96 161.72 37.38 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.144 -177.44 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 43.2 m -102.02 153.88 19.48 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 119.651 -0.819 . . . . 0.0 110.054 174.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -149.82 156.7 42.26 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.933 -179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -143.44 163.0 34.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 173.905 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -62.84 -46.73 86.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.302 -0.874 . . . . 0.0 112.657 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 145.09 76.29 0.03 OUTLIER Glycine 0 N--CA 1.465 0.597 0 C-N-CA 119.683 -1.246 . . . . 0.0 110.852 178.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.2 m -153.77 65.14 0.73 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.679 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.104 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.43 178.479 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.6 p90 . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 122.304 1.05 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -107.97 -64.12 1.25 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.174 -178.433 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -77.94 -49.67 13.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 119.499 -0.881 . . . . 0.0 112.011 -177.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.94 -36.99 75.7 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.997 -179.301 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -74.29 -37.98 63.51 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.012 178.797 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -67.77 -38.01 82.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.946 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -64.88 -37.3 87.16 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.615 176.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.42 66.85 0.68 Allowed Glycine 0 N--CA 1.466 0.681 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -178.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.97 170.74 30.72 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 119.503 -1.332 . . . . 0.0 111.48 -176.921 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -126.94 152.01 47.71 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 176.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.8 m -80.71 135.5 36.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.167 0.984 . . . . 0.0 111.418 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.9 m-85 -139.11 143.87 38.52 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.178 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.77 163.23 2.05 Favored 'Trans proline' 0 C--N 1.331 -0.361 0 C-N-CA 121.657 1.571 . . . . 0.0 112.213 171.051 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -85.12 45.9 1.22 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.713 -174.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -145.41 -29.02 0.44 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -173.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -87.44 172.82 9.52 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.273 1.035 . . . . 0.0 111.961 -171.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.48 139.97 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 122.381 1.086 . . . . 0.0 110.284 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -116.12 142.65 46.53 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 168.586 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -135.41 114.76 11.5 Favored Pre-proline 0 C--N 1.325 -0.49 0 C-N-CA 119.301 -0.96 . . . . 0.0 108.61 -174.094 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.97 158.75 96.24 Favored 'Cis proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.375 -1.511 . . . . 0.0 111.699 2.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.92 -27.79 0.87 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.163 1.242 . . . . 0.0 114.444 -168.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.406 ' C ' ' HG ' ' A' ' 23' ' ' SER . 50.5 m -94.7 59.26 2.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.15 -0.969 . . . . 0.0 111.434 -172.086 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.406 ' HG ' ' C ' ' A' ' 22' ' ' SER . 41.4 m -166.18 69.16 0.12 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 175.478 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -128.45 130.27 47.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 122.171 0.986 . . . . 0.0 110.538 -176.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 23.5 m-85 -86.56 170.06 12.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.22 178.426 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.03 -137.84 6.34 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 119.54 -1.314 . . . . 0.0 111.202 -178.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -76.22 115.3 15.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.335 177.858 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' MET . . . . . 0.593 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.1 mtp -119.42 -95.95 0.48 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.72 -0.792 . . . . 0.0 109.051 -175.695 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.519 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 2.9 m-20 -107.79 53.71 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.33 179.602 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.519 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 58.2 m -152.2 -163.63 1.78 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.94 -178.88 5.73 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 120.932 -1.105 . . . . 0.0 111.681 -171.674 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -58.23 -51.78 68.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -171.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -95.56 7.55 45.92 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.614 -0.834 . . . . 0.0 113.191 -170.156 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -104.05 162.09 13.44 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.117 -0.989 . . . . 0.0 109.781 -178.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -132.66 167.3 20.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.971 -174.683 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.593 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 43.2 t -114.28 106.9 14.89 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.653 -174.093 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 t -92.65 148.4 22.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.161 -1.016 . . . . 0.0 111.801 -174.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -129.92 158.79 38.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.893 0.854 . . . . 0.0 109.098 178.942 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -83.35 -172.28 4.05 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.117 0.961 . . . . 0.0 110.59 175.137 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.87 -76.4 1.13 Allowed Glycine 0 CA--C 1.524 0.609 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.446 176.188 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.8 p -92.91 70.72 4.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.03 0.919 . . . . 0.0 110.051 177.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.217 0 C-N-CA 119.711 -1.233 . . . . 0.0 110.118 179.936 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 61.8 t80 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -88.49 -71.65 0.58 Allowed 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.321 -0.862 . . . . 0.0 110.679 -178.814 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -77.46 -40.98 41.3 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.0 -176.172 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 10.5 t -73.1 -28.28 62.18 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.673 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -67.34 -28.78 68.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -174.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -54.88 -43.71 73.41 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 119.539 -0.865 . . . . 0.0 110.877 171.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -74.86 -48.99 22.09 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.723 173.17 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.28 84.5 1.18 Allowed Glycine 0 N--CA 1.467 0.729 0 C-N-CA 120.277 -0.963 . . . . 0.0 110.853 178.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.73 163.82 32.83 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 119.135 -1.507 . . . . 0.0 112.616 -176.68 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -120.83 154.93 35.11 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.651 0.739 . . . . 0.0 109.305 177.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.7 m -80.53 139.14 36.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.258 1.028 . . . . 0.0 111.574 -178.156 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -142.59 158.57 59.88 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 172.791 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.51 175.56 2.72 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 121.475 1.45 . . . . 0.0 113.395 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -93.39 75.46 4.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.614 0.721 . . . . 0.0 110.459 -176.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -169.29 -32.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.422 -177.436 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -85.47 172.18 11.2 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.55 1.167 . . . . 0.0 112.088 -173.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -87.74 134.01 28.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.816 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.65 105.25 17.36 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 171.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.401 ' HA ' ' C ' ' A' ' 20' ' ' PRO . 23.9 tp -118.75 132.52 23.85 Favored Pre-proline 0 N--CA 1.469 0.48 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.173 -169.313 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.401 ' C ' ' HA ' ' A' ' 19' ' ' LEU . 62.2 Cg_exo -66.3 167.66 52.73 Favored 'Cis proline' 0 CA--C 1.532 0.411 0 CA-C-N 120.988 1.388 . . . . 0.0 114.0 4.427 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.81 75.16 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 121.444 1.429 . . . . 0.0 111.122 -169.076 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.2 p -140.05 -66.35 0.45 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.511 -177.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.9 m -99.39 81.95 2.6 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.713 0.768 . . . . 0.0 111.27 -172.474 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -106.61 118.08 35.74 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 172.505 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -95.7 153.74 17.57 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.7 -176.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.49 -122.77 1.97 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 119.667 -1.254 . . . . 0.0 111.363 -177.072 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -75.69 99.64 4.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 119.219 -0.992 . . . . 0.0 109.12 175.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 90.1 mmm -99.43 -120.39 0.15 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 176.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -103.62 40.77 1.37 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.089 -1.045 . . . . 0.0 110.714 170.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.9 m -93.97 -165.47 1.33 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 170.341 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -86.04 -171.21 3.46 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.752 -1.218 . . . . 0.0 109.918 176.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -59.47 -45.59 91.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -170.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -107.82 15.93 24.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -173.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -111.77 172.77 6.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.115 -0.991 . . . . 0.0 110.404 178.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HB2' ' HZ1' ' A' ' 35' ' ' LYS . 9.7 mtmp? -135.89 171.03 15.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.153 -0.619 . . . . 0.0 111.003 -174.919 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.3 t -113.71 143.42 44.64 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.787 -0.57 . . . . 0.0 109.94 177.164 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 19.5 t -125.26 143.2 51.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.851 0.834 . . . . 0.0 111.444 -175.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -139.25 148.53 43.17 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 173.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -79.66 -177.41 5.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.142 0.972 . . . . 0.0 111.712 178.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -110.47 -70.89 0.64 Allowed Glycine 0 N--CA 1.467 0.756 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 170.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.2 t -151.16 88.91 1.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 171.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 119.283 -1.437 . . . . 0.0 111.056 -177.249 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.7 tptp . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -76.72 -47.85 20.61 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.502 -0.749 . . . . 0.0 112.082 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -64.03 -40.27 95.96 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -172.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -66.95 -29.39 69.24 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -70.96 -48.78 51.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.763 -0.586 . . . . 0.0 112.549 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.88 -50.13 25.67 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.264 -0.898 . . . . 0.0 112.182 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.79 69.1 0.06 OUTLIER Glycine 0 N--CA 1.469 0.838 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.95 163.92 37.09 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.304 -176.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -137.49 144.03 42.02 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 92.9 m -78.77 133.57 37.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.151 0.977 . . . . 0.0 111.44 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -139.86 146.87 48.94 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.62 152.95 15.31 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.641 1.56 . . . . 0.0 112.527 171.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -23.61 60.98 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -89.45 -23.53 22.09 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -79.63 155.7 27.98 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.238 1.018 . . . . 0.0 111.583 -173.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.64 130.54 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 122.19 0.995 . . . . 0.0 112.049 -173.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.4 t -108.94 139.15 44.19 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 166.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.2 111.31 12.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.67 159.38 96.71 Favored 'Cis proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.957 7.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -86.04 -38.11 0.1 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 121.341 1.361 . . . . 0.0 114.904 -168.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.2 t -93.6 62.43 3.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.934 0.873 . . . . 0.0 111.859 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.6 p -162.53 98.27 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -150.39 141.86 23.42 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.781 1.277 . . . . 0.0 113.259 -170.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.496 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 62.5 m-85 -94.27 159.92 14.91 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.141 169.077 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.15 -124.95 2.52 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.378 -175.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.85 77.45 10.09 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.644 1.211 . . . . 0.0 110.281 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.653 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 96.4 mtp -73.42 -64.02 1.07 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.183 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.477 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 30.1 t70 -138.44 44.5 2.1 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.666 0.746 . . . . 0.0 109.367 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 86.5 m -153.35 -176.81 5.96 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.92 0.867 . . . . 0.0 110.76 -171.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -79.84 -177.68 6.06 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.245 1.021 . . . . 0.0 112.754 -170.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -60.89 -56.86 16.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -77.12 -4.41 44.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -175.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -108.58 153.01 23.98 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.166 -0.959 . . . . 0.0 109.334 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -140.19 153.56 46.65 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.641 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 35.7 m -91.07 124.22 35.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.246 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.0 t -79.15 155.88 28.49 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.304 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 121.501 0.667 . . . . 0.0 110.895 -169.704 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 98.2 mttt . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.408 ' OE1' ' SD ' ' A' ' 28' ' ' MET . 46.0 tt0 -76.67 -44.62 33.07 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.382 -0.824 . . . . 0.0 112.995 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -66.15 -38.6 88.52 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.797 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -63.31 -31.12 72.18 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -62.96 -44.17 96.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.838 -0.539 . . . . 0.0 112.156 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -70.65 -45.88 64.31 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.495 -0.753 . . . . 0.0 111.737 172.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.77 83.93 0.9 Allowed Glycine 0 N--CA 1.468 0.781 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.06 -166.58 24.26 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 119.577 -1.296 . . . . 0.0 112.222 -175.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -147.05 152.15 38.07 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.761 0.791 . . . . 0.0 108.986 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.1 m -79.8 123.99 28.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.054 -0.658 . . . . 0.0 110.177 175.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 37' ' ' CYS . 96.9 m-85 -126.35 148.36 63.6 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 175.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.13 156.66 19.7 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 121.592 1.528 . . . . 0.0 112.08 171.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -62.4 -31.16 71.8 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -99.25 -23.1 15.31 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -89.7 -161.22 0.76 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.529 -0.732 . . . . 0.0 111.75 -168.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.0 mt -79.1 139.19 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 122.707 1.242 . . . . 0.0 112.774 -169.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.2 t -116.02 144.48 44.05 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 166.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -141.65 110.58 6.23 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 119.461 -0.896 . . . . 0.0 108.866 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.99 154.4 87.81 Favored 'Cis proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.531 -1.445 . . . . 0.0 111.622 0.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -77.68 -33.53 2.27 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 121.273 1.315 . . . . 0.0 115.123 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.6 m -93.18 66.06 4.01 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.384 -0.823 . . . . 0.0 111.044 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.495 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 55.4 m -163.74 74.64 0.33 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -101.33 141.85 33.59 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.548 1.166 . . . . 0.0 111.521 -172.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -117.59 152.45 35.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.031 175.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -76.03 -148.19 2.24 Favored Glycine 0 N--CA 1.47 0.967 0 C-N-CA 119.684 -1.246 . . . . 0.0 112.894 -173.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -81.11 95.29 6.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.815 1.293 . . . . 0.0 108.874 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.656 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 25.4 mmm -98.48 -74.52 0.58 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.844 -171.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -146.58 61.3 1.21 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 74.0 m -129.97 -103.0 0.3 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -149.27 -171.55 3.91 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.398 -0.814 . . . . 0.0 109.203 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -60.16 -55.98 27.22 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -171.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -94.41 10.83 32.84 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -109.85 164.74 12.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.445 1.117 . . . . 0.0 110.082 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -130.21 159.39 37.0 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.17 -176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 43.9 m -90.01 157.08 17.98 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.102 -1.039 . . . . 0.0 108.768 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 23' ' ' SER . 11.1 t -158.23 -178.83 7.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.894 0.854 . . . . 0.0 109.105 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 tptm . . . . . 0 C--N 1.325 -0.491 0 CA-C-O 121.829 0.823 . . . . 0.0 110.227 -174.352 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.1 tptm . . . . . 0 N--CA 1.47 0.537 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -79.0 -55.51 5.07 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.719 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 77.8 m -62.98 -29.11 70.56 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.06 -29.55 67.7 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.303 -0.873 . . . . 0.0 112.494 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -58.7 -50.77 72.65 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.653 -0.655 . . . . 0.0 111.46 173.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.0 -47.11 81.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.303 172.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 103.61 55.84 0.78 Allowed Glycine 0 N--CA 1.468 0.791 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.466 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.69 -152.29 7.69 Favored Glycine 0 N--CA 1.468 0.803 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -150.47 148.72 29.07 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.17 0.986 . . . . 0.0 109.992 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.5 t -80.92 113.81 19.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.785 0.802 . . . . 0.0 110.786 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -124.73 157.65 65.18 Favored Pre-proline 0 N--CA 1.471 0.579 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.556 178.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -58.77 157.88 26.5 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.849 1.7 . . . . 0.0 113.793 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -63.27 -27.85 69.62 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.91 -30.37 58.75 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -74.48 154.48 38.69 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.228 1.013 . . . . 0.0 111.197 -171.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.0 mt -79.47 124.48 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 122.022 0.915 . . . . 0.0 111.077 -169.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.418 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 49.4 t -95.49 140.51 30.24 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 169.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.21 119.31 29.67 Favored Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.03 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 166.77 82.06 Favored 'Cis proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.402 -1.499 . . . . 0.0 111.419 1.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -51.36 -49.81 15.95 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 122.098 1.865 . . . . 0.0 115.464 -172.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.9 p -92.58 56.73 2.77 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.638 0.732 . . . . 0.0 111.818 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.8 m -145.34 69.89 1.25 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 122.426 1.108 . . . . 0.0 109.574 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.418 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 5.1 p30 -144.27 151.42 39.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.083 0.944 . . . . 0.0 109.12 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.625 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 36.1 m-85 -98.04 170.2 9.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.608 0.718 . . . . 0.0 109.07 175.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.08 -142.82 3.47 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.673 -1.251 . . . . 0.0 112.441 -171.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -79.16 81.98 5.37 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.782 1.277 . . . . 0.0 109.57 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.719 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 95.1 mtp -82.17 -111.02 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.466 -178.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -91.24 64.13 5.14 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 t -142.64 169.71 17.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -169.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 51.0 ttt85 -67.75 166.44 15.31 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.321 -0.862 . . . . 0.0 110.753 -177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -51.29 -46.84 62.62 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -108.88 28.23 8.67 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.238 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -111.51 168.91 9.18 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.301 -0.874 . . . . 0.0 109.347 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -135.46 149.1 49.47 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.484 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.7 m -89.48 114.91 26.48 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.803 0.811 . . . . 0.0 109.56 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 50.0 t -84.98 126.77 33.8 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.944 0.878 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 57.0 tptt . . . . . 0 C--N 1.324 -0.501 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -176.887 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 122.412 1.101 . . . . 0.0 113.139 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -68.75 -52.22 32.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.175 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.0 t -68.21 -29.54 68.41 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.351 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -68.76 -30.14 68.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.908 174.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -67.01 -36.24 81.7 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -82.47 -53.32 6.08 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.004 174.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.64 81.83 0.14 Allowed Glycine 0 N--CA 1.467 0.708 0 C-N-CA 119.992 -1.099 . . . . 0.0 110.582 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.75 170.33 40.5 Favored Glycine 0 N--CA 1.468 0.773 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.98 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -132.03 155.02 48.76 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.2 m -81.29 136.57 35.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.814 0.816 . . . . 0.0 112.282 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -134.1 149.63 72.02 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.05 173.49 0.9 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 121.885 1.724 . . . . 0.0 114.019 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.25 -48.9 16.3 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.524 -0.735 . . . . 0.0 111.487 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -29.88 70.95 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -86.42 137.52 32.49 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.727 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.4 mt -100.5 133.55 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 CA-C-O 121.795 0.807 . . . . 0.0 110.813 -170.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 p -102.39 149.51 24.29 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.4 tp -117.61 131.06 24.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -174.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.7 160.54 90.67 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.207 1.467 . . . . 0.0 113.363 5.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -85.19 -30.6 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 121.254 1.303 . . . . 0.0 113.996 -169.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.5 m -93.45 52.62 1.76 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.312 -0.868 . . . . 0.0 110.771 178.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -150.23 77.88 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.65 0.738 . . . . 0.0 109.193 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -157.95 158.9 35.85 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.311 1.053 . . . . 0.0 111.245 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.446 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 57.7 m-85 -99.66 170.04 8.85 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.342 -0.845 . . . . 0.0 109.645 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.09 -133.76 4.39 Favored Glycine 0 N--CA 1.47 0.902 0 C-N-CA 119.806 -1.188 . . . . 0.0 112.907 -170.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -84.92 86.88 7.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.16 0.981 . . . . 0.0 108.471 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.446 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 74.1 mtp -84.5 -76.26 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.894 -171.432 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -128.72 12.02 6.26 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 79.9 m -114.1 -157.78 0.64 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.62 -0.675 . . . . 0.0 109.578 178.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -78.88 -178.87 6.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.377 1.084 . . . . 0.0 111.92 -171.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -63.51 -49.06 75.02 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -176.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -91.22 18.54 6.84 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -113.84 156.17 24.4 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -135.17 157.2 47.52 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.081 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.5 t -98.39 107.93 20.51 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.808 -176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.0 t -97.33 148.64 22.93 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.284 1.04 . . . . 0.0 111.571 -172.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.2 tttp . . . . . 0 N--CA 1.467 0.396 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.909 176.66 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 51.5 tptt . . . . . 0 N--CA 1.469 0.494 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.19 -49.88 14.19 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.342 -173.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.6 t -77.36 -28.65 53.0 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -70.77 -33.84 71.18 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.135 -0.978 . . . . 0.0 112.832 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -76.91 -39.36 51.13 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.726 -0.609 . . . . 0.0 111.629 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -71.75 -35.63 70.17 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.498 -0.751 . . . . 0.0 112.299 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.22 90.66 2.0 Favored Glycine 0 N--CA 1.47 0.934 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.824 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.1 146.25 9.78 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 119.52 -1.324 . . . . 0.0 112.324 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -101.57 143.8 31.11 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 175.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HE3' ' A' ' 34' ' ' TRP . 42.3 t -85.54 131.32 34.39 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.361 -0.837 . . . . 0.0 111.864 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -132.73 154.08 81.32 Favored Pre-proline 0 N--CA 1.471 0.62 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.79 163.47 15.91 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.836 1.69 . . . . 0.0 111.599 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.67 -4.62 16.3 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.33 -21.16 42.78 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -87.16 152.26 22.48 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.028 0.918 . . . . 0.0 112.57 -169.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -83.2 135.92 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 121.822 0.82 . . . . 0.0 109.05 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -96.09 119.16 34.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.726 0.774 . . . . 0.0 110.509 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.7 tp -121.35 134.36 24.47 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.88 168.33 76.85 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 123.676 -1.385 . . . . 0.0 111.72 2.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -58.53 -51.07 7.97 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.606 1.537 . . . . 0.0 114.777 -170.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 70.5 m -90.5 58.91 4.12 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.616 0.722 . . . . 0.0 111.468 -177.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.9 m -162.48 83.2 0.54 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.14 0.971 . . . . 0.0 108.672 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -157.33 160.8 38.87 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.61 0.719 . . . . 0.0 109.104 -171.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.9 m-85 -135.54 163.96 28.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.816 0.817 . . . . 0.0 110.14 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.05 -143.31 5.65 Favored Glycine 0 N--CA 1.47 0.911 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.093 -176.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -77.68 98.4 5.46 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.317 1.055 . . . . 0.0 109.016 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.554 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 85.2 mtp -90.19 -113.63 0.07 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.584 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -110.62 68.64 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.8 t -142.26 -88.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -141.47 155.37 45.84 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -55.85 -34.15 65.17 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -109.49 15.34 23.04 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.42 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 33.0 m0 -113.4 161.57 17.14 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.058 -1.026 . . . . 0.0 109.505 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -113.42 170.95 7.87 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.362 0.601 . . . . 0.0 110.364 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.9 t -119.92 97.15 5.47 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.443 -0.785 . . . . 0.0 109.174 173.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.3 t -86.12 150.54 24.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.768 0.794 . . . . 0.0 111.545 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt . . . . . 0 N--CA 1.466 0.362 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.7 179.993 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt . . . . . 0 N--CA 1.468 0.455 0 CA-C-O 120.643 0.259 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -77.38 -47.89 18.7 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.563 -0.71 . . . . 0.0 112.47 -174.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.7 t -62.99 -30.29 71.48 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -76.96 -38.09 53.94 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.459 -0.776 . . . . 0.0 112.092 174.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -69.82 -42.48 73.6 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.593 -0.692 . . . . 0.0 112.504 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -71.69 -63.02 1.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.316 -0.865 . . . . 0.0 111.235 177.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.84 83.7 0.05 OUTLIER Glycine 0 N--CA 1.467 0.723 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.627 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.19 163.76 37.43 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.664 -1.255 . . . . 0.0 111.242 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -123.78 147.28 47.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.6 m -78.47 125.28 29.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.755 0.788 . . . . 0.0 110.716 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -132.98 156.56 79.95 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.8 136.72 77.97 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.898 1.732 . . . . 0.0 112.294 175.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -76.87 -29.59 55.87 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -172.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.13 -28.26 69.94 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 172.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -81.52 144.76 31.09 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.096 0.95 . . . . 0.0 109.279 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -87.71 133.92 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.864 0.84 . . . . 0.0 111.203 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 57.7 m -74.67 131.08 40.59 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 168.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.51 116.58 31.94 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.79 163.49 85.88 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.482 -1.466 . . . . 0.0 112.56 7.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -72.01 -27.06 17.75 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.892 1.728 . . . . 0.0 113.834 -175.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.3 p -71.1 -28.92 64.66 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.51 -0.744 . . . . 0.0 112.804 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -84.46 81.9 8.64 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.483 -0.761 . . . . 0.0 109.395 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -150.29 130.38 13.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 122.575 1.179 . . . . 0.0 111.058 -173.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.613 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 26.9 m-85 -106.4 152.24 23.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.327 173.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.56 -133.92 3.67 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.914 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -80.52 83.89 6.23 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.754 1.264 . . . . 0.0 110.213 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.613 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 94.1 mtp -81.17 -69.1 0.63 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.857 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -151.72 57.65 0.86 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 84.9 m -123.32 -105.36 0.36 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -155.17 -169.21 3.1 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.349 -0.844 . . . . 0.0 109.114 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 45.7 t-105 -60.99 -51.76 67.88 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.31 -0.869 . . . . 0.0 112.987 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -85.58 -0.07 53.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -120.23 150.92 39.91 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.803 1.183 . . . . 0.0 109.767 -177.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -134.21 177.21 7.92 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.132 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -103.46 136.76 42.6 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.076 -1.015 . . . . 0.0 110.951 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 79.6 m -84.49 142.05 30.33 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt . . . . . 0 N--CA 1.469 0.487 0 CA-C-O 122.019 0.914 . . . . 0.0 110.391 -176.009 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -78.49 -44.5 24.32 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.39 -40.75 95.49 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -71.32 -36.43 71.58 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.635 -0.666 . . . . 0.0 112.213 176.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -67.64 -38.04 83.29 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -72.39 -51.75 19.04 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.178 -0.952 . . . . 0.0 111.629 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.58 72.91 0.03 OUTLIER Glycine 0 N--CA 1.467 0.752 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.113 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.52 -174.16 42.76 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 119.522 -1.323 . . . . 0.0 112.24 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -143.82 153.06 41.98 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.03 119.12 21.71 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.986 0.898 . . . . 0.0 110.773 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.89 152.38 75.24 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -60.03 168.93 5.3 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 121.49 1.46 . . . . 0.0 113.882 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -58.73 -51.39 70.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.373 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.0 -26.97 69.1 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.05 134.33 42.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 122.162 0.982 . . . . 0.0 109.969 176.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.1 mt -85.19 132.24 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-O 121.821 0.82 . . . . 0.0 111.356 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 94.0 m -78.23 136.52 37.8 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.8 117.93 30.84 Favored Pre-proline 0 N--CA 1.469 0.505 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.406 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 59.1 Cg_endo -80.32 166.24 76.48 Favored 'Cis proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.269 -1.555 . . . . 0.0 112.846 8.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 74.1 Cg_exo -59.35 -39.49 76.68 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 121.922 1.748 . . . . 0.0 115.102 -173.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -90.06 59.43 4.5 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.976 0.893 . . . . 0.0 110.823 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.3 t -161.27 85.75 0.67 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.444 ' OD1' ' SG ' ' A' ' 18' ' ' CYS . 27.8 t70 -157.23 126.68 6.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.743 -0.783 . . . . 0.0 109.572 -169.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -83.12 154.03 24.53 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.77 -129.87 1.16 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 119.68 -1.248 . . . . 0.0 112.092 -174.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -84.23 94.97 8.53 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.784 0.802 . . . . 0.0 108.981 177.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 40.9 mmm -89.5 -77.52 0.38 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.994 -172.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -145.86 43.85 1.26 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.777 0.799 . . . . 0.0 111.454 -176.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 88.5 m -134.11 -151.21 0.43 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -83.04 -178.61 7.18 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.622 -1.299 . . . . 0.0 111.567 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.1 t-105 -57.95 -54.09 50.91 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -92.98 25.26 3.28 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.023 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -114.16 154.89 27.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 122.394 1.092 . . . . 0.0 110.012 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -120.29 164.1 16.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.965 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.6 t -110.85 112.19 23.87 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 169.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -78.62 143.8 36.06 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.238 -173.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.929 174.74 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -78.19 -49.48 13.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.3 t -68.0 -33.66 75.04 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.439 -0.904 . . . . 0.0 113.199 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.06 -30.51 70.59 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.028 -0.669 . . . . 0.0 112.751 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -66.4 -44.34 83.28 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.908 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.58 -50.43 11.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.748 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.25 92.27 0.44 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 120.022 -1.085 . . . . 0.0 110.85 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.99 172.13 42.11 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.954 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -130.87 143.31 50.64 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 m -78.16 128.56 33.97 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.343 1.068 . . . . 0.0 110.967 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -132.14 147.35 65.45 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.98 149.2 63.43 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 121.411 1.407 . . . . 0.0 112.213 175.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.93 -29.43 69.61 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -64.31 -25.06 67.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -79.06 150.48 31.86 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.481 -0.762 . . . . 0.0 110.374 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -78.42 113.42 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 122.055 0.931 . . . . 0.0 110.643 -173.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 42.5 t -85.43 124.49 32.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 169.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -125.81 116.57 24.39 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.42 163.7 89.69 Favored 'Cis proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.44 -1.483 . . . . 0.0 112.019 5.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.62 -29.82 60.65 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.97 1.78 . . . . 0.0 114.25 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 93.1 p -96.93 50.46 1.1 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.576 -0.703 . . . . 0.0 111.803 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 92.1 p -152.11 78.53 1.23 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.371 1.082 . . . . 0.0 109.626 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.4 p30 -156.84 158.14 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 122.192 0.996 . . . . 0.0 108.827 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.449 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 88.3 m-85 -91.53 174.01 7.59 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 170.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -137.73 5.69 Favored Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.313 -1.422 . . . . 0.0 111.09 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -79.48 97.98 6.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.942 0.877 . . . . 0.0 108.874 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 61.2 mtp -89.34 -121.4 0.05 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.114 -172.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.54 48.51 1.15 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.369 -0.832 . . . . 0.0 110.808 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 99.8 m -131.53 -93.39 0.39 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -157.54 -176.1 5.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.824 -1.173 . . . . 0.0 112.482 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -60.39 -55.46 33.25 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -90.55 23.36 3.05 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -175.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -119.93 142.75 48.45 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.099 -1.001 . . . . 0.0 109.474 177.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -113.88 157.96 21.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.683 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.402 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 4.3 t -100.51 107.13 18.75 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.955 174.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 46.4 t -81.5 142.81 32.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 122.143 0.973 . . . . 0.0 111.095 -172.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt . . . . . 0 C--N 1.326 -0.435 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 N--CA 1.47 0.55 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -78.4 -51.65 9.73 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -171.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.6 t -65.97 -29.96 70.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -76.03 -32.46 59.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.489 -0.757 . . . . 0.0 112.567 175.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -68.39 -45.35 72.93 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.83 -0.544 . . . . 0.0 112.065 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -78.54 -28.44 46.1 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.638 -0.663 . . . . 0.0 112.579 176.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.99 60.83 0.71 Allowed Glycine 0 N--CA 1.468 0.822 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.372 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.6 157.07 17.99 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -107.51 140.01 41.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.11 129.96 35.0 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.631 0.729 . . . . 0.0 111.096 -177.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -141.55 159.83 58.94 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -63.32 144.14 90.66 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 121.736 1.624 . . . . 0.0 112.737 176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -73.9 -55.09 6.6 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.468 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.15 -30.51 70.43 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -92.67 169.66 10.33 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 122.14 0.971 . . . . 0.0 109.968 174.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.6 mt -74.67 124.67 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 121.518 -0.739 . . . . 0.0 111.187 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -100.15 144.44 29.17 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 169.023 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -119.33 117.82 32.88 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.72 162.65 74.78 Favored 'Cis proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.641 9.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -88.34 -55.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 121.128 1.219 . . . . 0.0 113.398 -169.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 97.3 p -85.6 48.9 1.66 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.601 -0.687 . . . . 0.0 112.574 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 79.0 p -167.81 72.51 0.11 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -134.87 153.7 51.95 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.9 1.333 . . . . 0.0 112.513 -169.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.515 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 73.3 m-85 -94.7 164.31 13.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.938 173.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.29 -138.85 5.76 Favored Glycine 0 N--CA 1.468 0.832 0 C-N-CA 119.987 -1.101 . . . . 0.0 112.029 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -82.22 90.09 6.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.962 0.887 . . . . 0.0 108.892 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.515 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 88.6 mtp -86.01 -86.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -175.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -140.72 50.6 1.66 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 122.052 0.93 . . . . 0.0 109.223 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 85.9 m -98.98 -90.92 0.29 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -150.21 -179.88 7.54 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -57.99 -54.85 42.22 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.826 -1.171 . . . . 0.0 113.332 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -94.96 11.78 30.68 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -105.94 162.84 13.23 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 120.364 -1.46 . . . . 0.0 111.209 -174.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 61.2 pttt -144.12 171.87 13.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.164 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.3 m -104.1 145.93 29.47 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.099 -1.0 . . . . 0.0 110.587 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -130.47 155.68 46.05 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.475 -0.766 . . . . 0.0 109.999 173.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.3 -174.286 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.662 0.268 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.494 ' NE2' ' SD ' ' A' ' 28' ' ' MET . 20.0 tt0 -78.31 -48.33 15.9 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -171.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.31 -39.65 89.46 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -70.54 -37.18 74.03 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -67.73 -43.6 79.58 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.444 -0.785 . . . . 0.0 112.585 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.99 -50.59 40.03 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.951 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.79 72.56 0.07 OUTLIER Glycine 0 N--CA 1.467 0.748 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.933 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.98 152.52 17.48 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 119.533 -1.317 . . . . 0.0 111.484 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -109.23 152.16 25.55 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.751 0.786 . . . . 0.0 109.577 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -79.87 126.18 30.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.17 0.986 . . . . 0.0 111.539 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -130.59 146.56 62.36 Favored Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.22 172.62 2.37 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 121.587 1.525 . . . . 0.0 113.106 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -68.2 -41.25 81.65 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 1.6 pm0 -75.88 -25.49 56.17 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -70.24 138.9 52.06 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 122.084 0.945 . . . . 0.0 110.091 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.8 mt -78.82 120.98 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 122.143 0.973 . . . . 0.0 110.642 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 43.5 t -85.65 126.3 33.82 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 169.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.27 116.5 30.94 Favored Pre-proline 0 N--CA 1.469 0.496 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -172.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.46 162.44 90.51 Favored 'Cis proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.464 5.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -70.14 -32.05 17.73 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.929 1.752 . . . . 0.0 114.132 -172.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.4 m -91.63 60.2 3.96 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.017 175.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -165.99 71.01 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.968 0.89 . . . . 0.0 109.206 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.488 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 3.3 p30 -154.56 151.61 29.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.837 0.827 . . . . 0.0 108.968 178.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -93.02 174.19 7.36 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.601 -0.84 . . . . 0.0 108.901 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.24 -134.79 3.77 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 119.748 -1.215 . . . . 0.0 110.936 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.65 123.76 25.45 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.494 ' SD ' ' NE2' ' A' ' 3' ' ' GLN . 78.8 mmm -117.98 -95.39 0.48 Allowed 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.249 -170.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -130.55 54.66 1.87 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 122.058 0.932 . . . . 0.0 109.852 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.6 m -144.85 -77.8 0.2 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.161 -0.615 . . . . 0.0 109.62 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -145.46 164.35 31.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.735 0.779 . . . . 0.0 109.539 -173.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -61.62 -49.37 76.85 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -102.31 30.57 4.47 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -114.24 154.37 28.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.121 -0.987 . . . . 0.0 109.051 175.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -114.93 160.57 19.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.913 0.863 . . . . 0.0 111.58 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.72 103.78 13.14 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 44.4 t -79.66 148.61 31.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 122.211 1.005 . . . . 0.0 111.282 -172.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 121.787 0.803 . . . . 0.0 109.665 -175.839 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 tptp . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.568 0.223 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -78.77 -50.19 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -175.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.85 -36.03 81.92 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -75.94 -32.69 59.67 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 112.693 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -66.26 -42.36 88.64 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.73 -0.606 . . . . 0.0 112.072 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -69.33 -48.35 61.67 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.579 -0.849 . . . . 0.0 110.66 171.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.72 92.88 1.41 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -174.52 170.31 43.4 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 118.912 -1.613 . . . . 0.0 112.709 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -131.0 153.63 49.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 99.2 m -79.42 120.49 23.9 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 122.069 0.937 . . . . 0.0 110.992 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -116.81 154.28 49.44 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 171.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -60.97 172.55 2.91 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 121.393 1.395 . . . . 0.0 113.94 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -62.39 -44.78 95.63 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.84 -27.28 69.06 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -174.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -75.55 141.17 43.02 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.295 1.045 . . . . 0.0 111.26 -170.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.1 mt -81.51 133.46 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 121.948 0.88 . . . . 0.0 109.611 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 23' ' ' SER . 35.4 t -84.56 133.07 34.45 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.62 115.17 13.45 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -176.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -74.47 164.33 88.23 Favored 'Cis proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.309 -1.538 . . . . 0.0 111.947 4.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.51 -13.95 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 121.767 1.644 . . . . 0.0 114.48 -171.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 48.2 m -71.22 -24.0 62.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 177.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 69.0 m -100.42 50.02 0.9 Allowed 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.673 -0.642 . . . . 0.0 111.574 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -101.94 100.13 10.39 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 24.8 m-85 -99.28 159.6 14.88 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.571 -174.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.15 -144.94 2.48 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 119.717 -1.23 . . . . 0.0 112.121 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -82.2 74.72 9.16 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.449 1.119 . . . . 0.0 110.577 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.55 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 95.6 mtp -71.18 -79.61 0.07 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.505 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.05 52.95 0.72 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 169.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.2 m -132.52 173.39 11.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.802 0.811 . . . . 0.0 109.946 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -79.96 -165.78 0.89 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.4 t-105 -52.48 -64.27 0.87 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -101.51 16.58 25.23 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -98.09 160.16 14.48 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.532 -1.355 . . . . 0.0 110.821 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -124.76 141.31 52.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.641 -169.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.35 122.42 30.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.9 t -128.35 144.58 51.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.618 0.723 . . . . 0.0 110.159 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp . . . . . 0 N--CA 1.468 0.427 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.513 176.196 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.42 -46.99 18.51 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.995 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.1 t -72.14 -29.15 63.77 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -64.99 -29.14 70.04 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.274 -0.891 . . . . 0.0 112.49 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -55.71 -45.26 77.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.432 -0.507 . . . . 0.0 111.937 173.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -76.88 -45.23 28.94 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.545 -0.722 . . . . 0.0 111.184 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.91 64.94 0.29 Allowed Glycine 0 N--CA 1.469 0.894 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.336 173.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.46 158.44 28.97 Favored Glycine 0 N--CA 1.467 0.761 0 C-N-CA 119.613 -1.279 . . . . 0.0 111.745 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -102.77 158.97 15.88 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.629 0.728 . . . . 0.0 109.759 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.0 m -79.34 138.58 37.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.106 0.955 . . . . 0.0 110.858 177.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.92 159.09 72.46 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -59.24 141.68 98.19 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.78 1.653 . . . . 0.0 113.237 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -72.06 -45.0 62.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.061 -0.655 . . . . 0.0 112.49 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.35 -28.78 67.15 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -174.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -94.36 158.64 15.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.196 0.998 . . . . 0.0 110.349 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.0 mt -83.89 132.67 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-O 121.817 0.817 . . . . 0.0 110.437 -172.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.34 137.57 32.21 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 169.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -115.44 118.57 39.35 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 72.0 Cg_endo -84.39 161.66 67.75 Favored 'Cis proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.425 -1.489 . . . . 0.0 112.49 8.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 47.1 Cg_exo -66.63 -39.46 15.76 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.617 1.545 . . . . 0.0 114.391 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 56.0 m -67.62 -36.92 81.74 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 m -85.05 78.63 9.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.76 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -143.09 150.83 40.03 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.414 1.102 . . . . 0.0 110.187 -171.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.592 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 32.5 m-85 -125.95 154.94 42.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.35 -175.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.31 -138.69 4.55 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.285 -172.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.92 85.5 6.21 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 122.018 0.913 . . . . 0.0 109.098 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.592 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 82.7 mtp -84.88 -108.66 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -177.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -108.23 66.8 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 171.3 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 90.2 m -129.06 -175.65 3.62 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.19 0.995 . . . . 0.0 111.015 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -77.96 170.59 16.34 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.676 0.751 . . . . 0.0 110.669 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -53.53 -55.53 24.75 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.8 mtm105 -94.52 22.93 5.66 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.577 177.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -116.96 159.6 22.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.535 1.159 . . . . 0.0 109.353 178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -133.85 173.05 11.96 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.776 176.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB3' ' HB2' ' A' ' 25' ' ' PHE . 5.8 t -99.69 155.02 17.84 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.912 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -148.56 150.93 34.2 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.541 -0.864 . . . . 0.0 109.536 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.3 tttt . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 121.916 0.865 . . . . 0.0 110.089 -179.561 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 120.676 0.274 . . . . 0.0 111.011 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -76.15 -38.75 56.35 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.431 -0.793 . . . . 0.0 112.14 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.4 t -55.41 -37.53 67.76 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -72.18 -39.09 68.93 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.723 -0.611 . . . . 0.0 112.279 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -66.27 -41.35 90.0 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.827 -0.546 . . . . 0.0 112.398 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -66.01 -38.55 88.74 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.423 -0.798 . . . . 0.0 111.656 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.16 83.84 1.7 Allowed Glycine 0 N--CA 1.467 0.734 0 C-N-CA 120.267 -0.968 . . . . 0.0 111.458 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.78 148.31 10.02 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.307 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -83.46 154.82 23.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.596 0.712 . . . . 0.0 109.183 175.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 37.2 m -78.76 125.3 29.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.724 -0.79 . . . . 0.0 110.133 177.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -128.98 148.34 68.56 Favored Pre-proline 0 N--CA 1.468 0.475 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.633 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -56.95 166.9 3.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.934 1.756 . . . . 0.0 113.55 173.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -61.67 -37.83 85.53 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.54 -20.13 66.21 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -176.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -75.69 124.46 27.28 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.381 -0.824 . . . . 0.0 111.106 -175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.3 mt -74.28 137.09 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.091 0.948 . . . . 0.0 109.638 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 33.5 t -88.56 123.95 33.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.0 tp -134.11 125.24 17.91 Favored Pre-proline 0 CA--C 1.538 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -70.46 167.14 73.97 Favored 'Cis proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.048 -1.647 . . . . 0.0 114.165 7.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -66.97 -30.13 39.84 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.702 1.601 . . . . 0.0 114.711 -171.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.6 m -69.35 -43.19 74.12 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -172.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -90.02 73.28 7.35 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.51 -0.744 . . . . 0.0 111.652 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -123.19 132.66 54.14 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -117.85 148.56 42.0 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.37 0.605 . . . . 0.0 109.45 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.64 -124.74 2.04 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.882 -175.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.97 113.12 16.83 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.3 mmm -117.91 -93.18 0.52 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -171.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -138.07 59.95 1.64 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 75.1 m -123.28 -88.93 0.61 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -179.046 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -159.54 -168.85 2.4 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 62.0 t-105 -61.95 -50.64 71.31 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -173.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -102.13 21.28 15.15 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -118.35 164.39 15.29 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 122.601 1.191 . . . . 0.0 110.304 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -132.81 178.8 6.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.702 -178.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 12.8 m -118.27 145.22 45.21 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.917 0.865 . . . . 0.0 109.752 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.8 t -141.89 141.36 33.02 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.904 0.859 . . . . 0.0 109.784 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 tttm . . . . . 0 N--CA 1.468 0.453 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.277 175.931 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -76.93 -49.02 16.52 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.734 -0.786 . . . . 0.0 112.533 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.9 t -75.13 -31.02 60.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.344 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -68.88 -29.1 67.32 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.366 -0.834 . . . . 0.0 111.958 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -61.61 -39.86 92.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.494 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -75.13 -45.53 40.4 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.38 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.89 91.14 1.37 Allowed Glycine 0 N--CA 1.466 0.639 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.34 -176.24 39.14 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 118.845 -1.645 . . . . 0.0 112.91 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -138.91 145.29 39.68 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.7 m -90.86 143.8 26.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.642 1.21 . . . . 0.0 112.232 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -141.47 158.82 62.63 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.374 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.54 164.13 3.25 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.821 1.681 . . . . 0.0 113.493 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.17 -22.57 62.95 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.57 -24.45 39.19 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -176.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -74.43 142.92 44.92 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.98 0.895 . . . . 0.0 110.821 -176.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.8 mt -82.0 131.81 32.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.92 0.867 . . . . 0.0 109.676 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 95.8 m -98.33 102.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 169.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.404 HD12 ' HD3' ' A' ' 21' ' ' PRO . 18.5 tp -110.38 133.61 21.05 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 163.31 86.11 Favored 'Cis proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.383 5.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HD3' HD12 ' A' ' 19' ' ' LEU . 50.8 Cg_endo -69.92 -24.33 29.07 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.645 1.563 . . . . 0.0 113.599 -171.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p -87.62 49.44 1.81 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 122.056 0.932 . . . . 0.0 110.49 174.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 t -150.91 51.4 0.86 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' SG ' ' A' ' 37' ' ' CYS . 32.3 t70 -140.64 129.19 22.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.652 0.739 . . . . 0.0 109.291 -171.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -116.21 162.12 17.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.9 -145.56 5.9 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 119.231 -1.461 . . . . 0.0 111.546 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -78.81 101.72 7.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.268 1.032 . . . . 0.0 108.952 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.409 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 90.9 mtp -96.92 -118.81 0.12 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -96.81 62.77 1.93 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.0 0.905 . . . . 0.0 108.719 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 50.3 m -146.92 -160.97 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.519 0.676 . . . . 0.0 110.301 -174.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -71.21 157.17 38.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.185 0.993 . . . . 0.0 110.913 -174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -56.79 -50.22 72.99 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.68 12.1 31.02 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.858 -177.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -108.82 172.0 7.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.378 -0.826 . . . . 0.0 108.868 175.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -139.59 173.82 11.14 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.626 -0.829 . . . . 0.0 110.591 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.409 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.8 t -109.44 153.08 24.53 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.557 -177.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 89.2 m -139.43 157.79 45.25 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.342 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.997 -179.814 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.3 tptm . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -74.11 -60.59 2.19 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.636 -0.826 . . . . 0.0 112.372 -170.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.6 t -78.37 -36.3 46.21 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.994 -1.066 . . . . 0.0 112.318 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -65.82 -37.37 86.07 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.061 -0.656 . . . . 0.0 112.404 -174.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -78.96 -29.82 44.17 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.065 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -79.36 -59.68 2.66 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.258 -0.902 . . . . 0.0 110.254 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.09 90.6 0.15 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 119.724 -1.227 . . . . 0.0 111.245 176.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.69 -177.13 40.5 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 119.017 -1.563 . . . . 0.0 112.68 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -138.17 150.35 46.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m -82.1 136.95 35.11 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 122.117 0.96 . . . . 0.0 112.354 -176.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -139.04 147.34 53.31 Favored Pre-proline 0 N--CA 1.467 0.398 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.9 148.21 48.01 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 121.729 1.619 . . . . 0.0 112.338 173.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -70.48 -45.05 66.45 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.553 -174.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.19 -33.58 74.81 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.31 147.89 29.66 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.974 0.893 . . . . 0.0 109.835 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -86.78 133.79 29.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.221 1.01 . . . . 0.0 111.303 -169.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.9 m -77.61 133.68 38.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.353 170.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.26 113.95 13.5 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -176.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.89 159.09 80.23 Favored 'Cis proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.184 -1.59 . . . . 0.0 112.627 10.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -93.9 48.52 0.31 Allowed 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 121.58 1.52 . . . . 0.0 111.123 -173.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -74.62 -41.35 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.172 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -149.3 120.13 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.625 -0.83 . . . . 0.0 109.864 -173.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -114.85 104.51 12.02 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.89 0.852 . . . . 0.0 109.536 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.7 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 63.6 m-85 -79.2 162.94 25.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.065 0.936 . . . . 0.0 110.354 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.2 -126.99 5.27 Favored Glycine 0 N--CA 1.465 0.602 0 C-N-CA 119.64 -1.267 . . . . 0.0 111.741 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -82.12 96.82 7.91 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.004 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.7 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 71.2 mtp -108.36 -116.01 0.28 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -177.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.437 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 60.8 m-20 -91.11 53.51 2.37 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.129 169.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.5 m -135.55 171.98 13.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.998 0.904 . . . . 0.0 110.78 -173.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -64.56 166.14 9.0 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.654 0.74 . . . . 0.0 110.541 179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.5 t-105 -55.17 -51.96 64.85 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -174.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -96.03 24.29 5.69 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.463 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -111.23 -174.37 2.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 122.115 0.96 . . . . 0.0 108.811 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -150.2 166.99 28.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.24 -172.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.553 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 1.8 t -111.47 140.53 45.99 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.194 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.5 m -121.11 152.46 38.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.16 0.981 . . . . 0.0 110.588 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 115.31 -0.859 . . . . 0.0 108.831 -177.33 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.0 tptm . . . . . 0 N--CA 1.467 0.379 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.56 -59.97 2.56 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.252 -170.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.447 ' H ' ' HB2' ' A' ' 29' ' ' ASP . 14.1 t -77.37 -30.75 53.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.968 -172.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.41 -34.87 78.67 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.594 -0.691 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -70.25 -41.04 74.03 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.762 177.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -74.79 -57.86 3.65 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.992 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.53 84.67 0.07 OUTLIER Glycine 0 N--CA 1.465 0.595 0 C-N-CA 119.837 -1.173 . . . . 0.0 110.466 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.67 169.21 39.06 Favored Glycine 0 CA--C 1.525 0.694 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.542 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -128.56 128.11 43.63 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 36' ' ' CYS . 48.7 t -80.81 136.15 36.07 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.321 1.058 . . . . 0.0 111.796 -175.191 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -138.51 158.41 70.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.81 -1.087 . . . . 0.0 108.202 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HA ' ' CG ' ' A' ' 34' ' ' TRP . 54.5 Cg_exo -61.72 178.46 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 121.442 1.428 . . . . 0.0 114.123 -179.177 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -61.8 -44.94 95.87 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.431 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -63.55 -26.5 68.73 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -76.05 133.01 40.46 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.507 -173.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.1 mt -81.3 131.12 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.913 0.864 . . . . 0.0 110.051 -175.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -86.42 134.54 33.69 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -133.7 113.76 12.99 Favored Pre-proline 0 C--N 1.325 -0.491 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -177.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.19 160.69 96.04 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 123.397 -1.501 . . . . 0.0 112.239 5.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.37 -26.66 10.14 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 121.837 1.692 . . . . 0.0 113.268 -174.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 84.6 p -71.23 -24.92 62.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.436 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.7 m -91.99 71.49 5.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.825 0.821 . . . . 0.0 109.851 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -142.81 119.57 11.18 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.52 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 71.6 m-85 -83.81 176.32 9.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.796 177.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.39 -133.4 5.82 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 119.422 -1.371 . . . . 0.0 110.718 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -76.4 117.34 17.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.416 -0.913 . . . . 0.0 108.877 176.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.52 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 82.9 mtp -122.44 -106.3 0.36 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.625 -175.055 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.447 ' HB2' ' H ' ' A' ' 4' ' ' CYS . 15.5 t70 -95.4 50.67 1.26 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.545 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 p -157.47 -89.2 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.323 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -159.64 -173.39 4.11 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.643 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 18.3 t-105 -54.94 -62.46 1.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -83.71 1.55 42.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.484 -0.886 . . . . 0.0 112.927 -170.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.401 ' CG ' ' HA ' ' A' ' 13' ' ' PRO . 34.5 m0 -97.11 150.05 21.28 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.231 -0.918 . . . . 0.0 109.157 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.38 159.46 24.16 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.977 -174.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.428 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 8.8 t -111.24 116.2 30.63 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.257 175.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.28 126.68 33.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.851 0.834 . . . . 0.0 110.209 -175.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.7 tttt . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 121.882 0.849 . . . . 0.0 109.028 178.5 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 121.285 0.564 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -77.35 -43.66 32.16 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.073 -177.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.47 ' SG ' ' SD ' ' A' ' 28' ' ' MET . 14.1 t -72.13 -29.1 63.73 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 119.237 -0.985 . . . . 0.0 113.553 -173.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -69.45 -31.67 70.13 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.329 -0.948 . . . . 0.0 111.404 176.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -66.15 -38.36 87.91 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.341 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -74.78 -49.18 21.77 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.271 175.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.89 80.31 0.46 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.69 169.58 42.07 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 119.023 -1.56 . . . . 0.0 112.757 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -118.99 150.22 40.31 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.6 m -80.46 137.42 36.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.198 0.999 . . . . 0.0 111.329 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -133.75 137.67 29.19 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.54 165.96 8.71 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 C-N-CA 121.548 1.499 . . . . 0.0 112.344 175.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -77.77 86.07 4.05 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.98 0.895 . . . . 0.0 109.602 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 -27.74 0.24 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.263 -176.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -127.54 169.66 13.46 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.993 1.378 . . . . 0.0 112.533 -171.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.0 mt -77.95 137.17 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.3 t -86.54 117.32 25.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -137.13 114.27 9.83 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -169.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -70.23 164.62 80.11 Favored 'Cis proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.967 -1.68 . . . . 0.0 113.674 8.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -85.12 -24.26 2.14 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.588 1.526 . . . . 0.0 113.512 -169.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 85.9 p -66.59 -26.86 67.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.328 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -94.61 47.4 1.17 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.001 -0.68 . . . . 0.0 111.557 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -108.07 102.99 12.11 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.469 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 89.8 m-85 -79.61 161.03 26.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.3 -131.54 5.15 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 119.055 -1.545 . . . . 0.0 111.316 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -82.45 99.38 9.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 70.6 mtp -93.04 -112.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.131 -173.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.52 33.39 4.55 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.137 -0.977 . . . . 0.0 111.921 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 58.7 m -111.35 -83.24 0.58 Allowed 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.292 -178.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.7 ptp180 -158.38 -175.37 5.29 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 118.532 -1.267 . . . . 0.0 111.299 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -63.35 -48.7 76.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.947 -1.024 . . . . 0.0 113.016 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -97.44 23.68 7.37 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.435 -0.906 . . . . 0.0 113.113 -175.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -117.56 152.31 35.37 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.061 -1.024 . . . . 0.0 109.587 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -110.7 166.94 10.61 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.511 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 17.0 t -120.64 127.84 52.45 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 169.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 47.2 t -130.05 154.01 47.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.573 0.701 . . . . 0.0 109.617 -173.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.114 179.957 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt . . . . . 0 N--CA 1.469 0.477 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.08 -47.73 17.65 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.17 -0.956 . . . . 0.0 111.505 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.61 -36.8 70.91 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -173.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -76.71 -42.98 39.35 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.359 -0.838 . . . . 0.0 111.621 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -62.98 -43.45 98.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.048 -0.661 . . . . 0.0 112.445 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -68.7 -33.63 74.29 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.761 -0.776 . . . . 0.0 112.322 -178.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.62 92.89 1.22 Allowed Glycine 0 N--CA 1.465 0.599 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.82 170.84 31.28 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 119.233 -1.461 . . . . 0.0 111.662 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.26 144.01 38.21 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -79.7 132.98 36.34 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.976 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -140.13 157.08 69.78 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -51.36 142.61 37.14 Favored 'Trans proline' 0 CA--C 1.53 0.304 0 C-N-CA 121.507 1.472 . . . . 0.0 110.547 169.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.83 -14.35 61.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -92.76 -20.5 20.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -90.25 -106.49 0.09 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.112 -169.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.8 mt -115.81 132.51 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 122.758 1.266 . . . . 0.0 111.309 -173.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 t -132.99 123.59 26.16 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.265 -2.494 . . . . 0.0 104.265 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -118.35 117.13 34.96 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -76.52 165.24 85.73 Favored 'Cis proline' 0 CA--C 1.534 0.518 0 C-N-CA 123.131 -1.612 . . . . 0.0 111.815 6.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -49.36 -65.21 0.17 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.31 2.007 . . . . 0.0 116.058 -168.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.7 m -97.75 65.23 1.82 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.063 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.2 m -154.17 108.83 3.06 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.396 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -160.76 149.22 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.373 1.082 . . . . 0.0 111.798 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.428 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 99.0 m-85 -84.41 164.62 18.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.49 -140.98 2.21 Favored Glycine 0 N--CA 1.466 0.663 0 C-N-CA 119.552 -1.308 . . . . 0.0 111.806 -172.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -80.59 100.0 8.4 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 122.736 1.255 . . . . 0.0 108.357 176.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 93.7 mtp -90.2 -81.24 0.3 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.633 -172.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -148.06 57.84 1.09 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 119.548 -0.861 . . . . 0.0 110.713 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.3 m -135.13 -102.15 0.22 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.852 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -135.81 166.78 22.49 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.456 -0.777 . . . . 0.0 109.331 -172.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -57.51 -60.19 4.03 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -85.77 14.35 6.01 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.704 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.0 m0 -111.7 132.19 54.79 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.128 -0.983 . . . . 0.0 108.685 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -115.18 158.74 21.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.894 0.854 . . . . 0.0 110.431 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 44.7 t -91.83 115.21 27.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -78.77 148.3 33.03 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.804 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt . . . . . 0 N--CA 1.47 0.557 0 CA-C-O 121.383 0.611 . . . . 0.0 110.973 -171.363 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 tptt . . . . . 0 N--CA 1.468 0.433 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.6 -61.61 1.94 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.814 -0.754 . . . . 0.0 112.412 -172.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 72.4 m -78.59 -33.94 47.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.189 -1.004 . . . . 0.0 113.391 -174.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -72.31 -41.42 66.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.192 -0.943 . . . . 0.0 112.867 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -65.55 -34.62 78.68 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.551 178.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -74.44 -47.86 31.06 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.455 173.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.11 69.17 0.18 Allowed Glycine 0 N--CA 1.465 0.593 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.991 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.47 -178.06 33.13 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 119.342 -1.408 . . . . 0.0 111.853 -177.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -155.51 158.93 39.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.9 m -78.81 120.27 23.2 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.338 -176.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 92.0 m-85 -120.02 152.3 54.0 Favored Pre-proline 0 N--CA 1.469 0.509 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 46.6 Cg_exo -69.52 153.29 70.21 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 121.37 1.38 . . . . 0.0 113.03 -175.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -68.89 -25.35 64.56 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.67 -26.46 66.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -91.54 137.26 32.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.748 0.785 . . . . 0.0 109.598 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.7 mt -85.93 124.78 40.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.778 -174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.1 t -93.77 138.46 31.93 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -125.46 122.87 24.99 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -171.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -81.0 165.99 75.23 Favored 'Cis proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.398 -1.501 . . . . 0.0 112.57 7.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.72 -12.39 15.03 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 121.723 1.615 . . . . 0.0 113.548 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.1 t -102.8 45.27 0.97 Allowed 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.452 -0.78 . . . . 0.0 111.512 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.0 p -160.55 63.73 0.32 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.862 0.839 . . . . 0.0 109.52 177.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -153.43 135.57 14.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.157 0.98 . . . . 0.0 109.114 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.717 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 82.7 m-85 -92.21 168.24 11.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.786 0.803 . . . . 0.0 109.4 179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.12 -116.05 2.68 Favored Glycine 0 N--CA 1.466 0.649 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.025 -174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -86.22 78.83 9.27 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.286 -0.965 . . . . 0.0 109.56 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.717 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.2 mtp -78.72 -85.28 0.08 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.8 p30 -120.94 40.52 3.53 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.045 0.926 . . . . 0.0 109.141 169.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 70.9 m -111.91 178.46 4.31 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.861 0.839 . . . . 0.0 110.557 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -95.35 -168.48 1.8 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.104 0.954 . . . . 0.0 111.24 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -55.69 -60.3 3.64 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -80.68 -6.01 57.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -111.38 163.54 13.89 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.853 -1.155 . . . . 0.0 110.509 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -147.64 166.67 26.71 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 57.8 m -94.0 120.25 33.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.059 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 t -97.02 142.76 28.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.955 174.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 121.546 0.689 . . . . 0.0 109.208 -179.309 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.5 tptm . . . . . 0 N--CA 1.464 0.258 0 CA-C-O 120.875 0.369 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -77.77 -51.47 10.48 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 119.848 -0.741 . . . . 0.0 112.016 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.7 t -58.87 -40.52 84.6 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -176.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -77.93 -39.04 44.08 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 119.503 -0.879 . . . . 0.0 112.444 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -72.56 -35.07 67.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.369 -0.832 . . . . 0.0 112.41 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -65.04 -42.96 93.84 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.51 -0.744 . . . . 0.0 111.499 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.84 76.53 0.15 Allowed Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.884 -1.151 . . . . 0.0 110.527 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -179.73 -179.16 48.76 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 118.897 -1.62 . . . . 0.0 112.125 -177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -136.43 144.23 44.33 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.7 t -79.72 132.86 36.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.27 1.033 . . . . 0.0 111.836 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.25 153.19 70.9 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -56.88 168.87 2.15 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 121.647 1.565 . . . . 0.0 112.905 175.553 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -80.28 -9.31 59.73 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.25 47.27 2.42 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.2 1.0 . . . . 0.0 111.915 -172.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -145.14 175.04 10.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.94 0.876 . . . . 0.0 110.255 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -90.74 122.85 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.734 0.778 . . . . 0.0 110.337 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.5 p -123.47 152.85 41.27 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.04 116.87 51.06 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -84.67 159.87 67.18 Favored 'Cis proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.297 -1.543 . . . . 0.0 112.05 9.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -82.73 -57.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 121.361 1.374 . . . . 0.0 112.781 -171.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m -92.98 58.69 3.01 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.374 -173.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 t -164.2 88.19 0.51 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.77 159.38 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.61 1.195 . . . . 0.0 111.875 -173.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.519 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 80.8 m-85 -97.71 179.22 4.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.497 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.07 -130.46 5.79 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 119.526 -1.321 . . . . 0.0 110.699 -176.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -81.93 109.08 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 118.954 -1.098 . . . . 0.0 108.787 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.595 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.3 mtp -107.45 -121.1 0.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.24 66.05 1.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.6 t -146.55 -142.25 0.13 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -83.41 160.6 21.56 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 120.943 -1.098 . . . . 0.0 109.997 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.3 t-105 -55.43 -38.1 68.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -110.45 14.15 22.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -104.89 151.85 23.35 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.036 -1.04 . . . . 0.0 109.867 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -110.3 165.81 11.47 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.067 0.937 . . . . 0.0 110.992 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.595 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 50.3 t -114.66 113.14 23.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -177.481 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 93.1 m -78.34 144.7 35.8 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.423 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 121.732 0.777 . . . . 0.0 110.337 -173.724 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt . . . . . 0 N--CA 1.467 0.379 0 CA-C-O 120.655 0.264 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -78.24 -50.74 11.31 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 119.696 -0.801 . . . . 0.0 112.411 -174.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.696 ' SG ' ' CB ' ' A' ' 28' ' ' MET . 86.5 m -62.96 -30.48 71.61 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.644 -0.822 . . . . 0.0 113.183 -177.604 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -72.13 -31.15 65.73 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.791 -0.764 . . . . 0.0 112.342 -179.2 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -71.55 -42.57 67.71 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.521 -0.737 . . . . 0.0 111.648 176.85 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.16 -44.9 59.31 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.447 -179.521 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.69 70.89 0.3 Allowed Glycine 0 N--CA 1.465 0.6 0 C-N-CA 120.031 -1.081 . . . . 0.0 110.406 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.32 159.32 30.35 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 119.627 -1.273 . . . . 0.0 110.534 -179.214 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -112.4 145.53 39.97 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 9.0 m -79.33 134.2 36.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.206 1.003 . . . . 0.0 110.873 179.335 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -142.5 154.57 63.58 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 176.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.07 161.51 2.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 121.648 1.565 . . . . 0.0 112.79 172.101 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -62.19 -29.48 70.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -178.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.58 -25.26 63.89 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.551 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -87.2 135.66 33.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.188 0.994 . . . . 0.0 110.728 -171.033 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -128.55 130.84 69.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.911 -176.894 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 29.2 p -91.91 101.85 14.42 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 170.414 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.42 HD12 ' HD3' ' A' ' 21' ' ' PRO . 14.7 tp -70.7 138.28 85.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.312 -172.361 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -85.04 168.08 52.62 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 123.647 -1.397 . . . . 0.0 112.618 8.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD3' HD12 ' A' ' 19' ' ' LEU . 56.7 Cg_endo -93.19 52.27 0.41 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 121.333 1.355 . . . . 0.0 111.649 -169.734 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.7 t -92.37 -59.4 2.09 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.981 -174.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -100.19 82.31 2.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.01 0.909 . . . . 0.0 109.386 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -109.82 103.79 12.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' HB2' ' A' ' 35' ' ' LYS . 52.5 m-85 -82.04 158.25 23.86 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.842 -0.743 . . . . 0.0 109.713 -177.868 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.3 -137.37 5.76 Favored Glycine 0 N--CA 1.468 0.792 0 C-N-CA 119.779 -1.201 . . . . 0.0 111.695 -174.393 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -76.01 104.89 6.76 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.355 1.074 . . . . 0.0 108.959 176.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.696 ' CB ' ' SG ' ' A' ' 4' ' ' CYS . 66.7 mmm -95.58 -76.36 0.5 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.844 -172.799 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -153.41 58.74 0.76 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.9 0.857 . . . . 0.0 110.1 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.5 m -141.45 -71.23 0.35 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.7 -175.556 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -151.26 165.55 33.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.866 0.841 . . . . 0.0 109.544 -177.425 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -60.48 -48.56 81.22 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -177.561 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -100.5 13.62 34.0 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.736 -0.785 . . . . 0.0 112.991 -177.574 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -108.27 165.81 11.22 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -146.73 174.9 11.04 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -175.558 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 99.1 m -110.29 123.74 50.37 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.612 176.707 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 45.1 t -104.96 149.67 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.117 0.961 . . . . 0.0 110.508 -177.92 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? . . . . . 0 C--N 1.325 -0.469 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -176.974 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.1 tptm . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 121.131 0.491 . . . . 0.0 109.982 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -78.99 -50.56 10.91 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.838 -172.838 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.8 t -70.94 -32.88 69.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 119.087 -1.045 . . . . 0.0 112.629 -172.812 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -67.52 -36.31 80.78 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.079 178.691 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.55 -42.7 95.54 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.573 179.012 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -72.46 -45.63 58.63 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.325 177.964 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 124.11 77.79 0.35 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.594 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.58 174.31 38.94 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 119.262 -1.447 . . . . 0.0 111.91 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -141.25 154.56 45.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.165 0.983 . . . . 0.0 109.655 -178.601 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.6 t -79.09 123.89 27.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.936 0.874 . . . . 0.0 111.39 -175.622 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -136.45 159.27 71.26 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.145 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.66 149.02 51.42 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.788 1.659 . . . . 0.0 112.678 177.116 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -73.08 -52.04 15.8 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.927 -176.755 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.84 -26.28 68.26 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -176.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -77.06 147.03 36.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.972 0.891 . . . . 0.0 110.722 -178.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.3 mt -71.16 135.7 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 122.214 1.007 . . . . 0.0 110.938 -177.049 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.7 t -95.0 116.3 28.52 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 168.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -124.43 117.42 26.56 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -172.512 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.19 159.29 93.04 Favored 'Cis proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.298 -1.542 . . . . 0.0 111.949 6.086 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -94.58 55.63 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 121.532 1.488 . . . . 0.0 111.56 -169.619 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.3 p -67.94 -64.01 0.95 Allowed 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.767 -0.773 . . . . 0.0 112.305 -173.116 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.1 m -144.18 112.72 6.55 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 119.359 -0.937 . . . . 0.0 110.465 -179.364 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -98.35 118.36 34.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.08 0.943 . . . . 0.0 109.347 175.32 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.67 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 78.0 m-85 -92.3 165.85 12.89 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.606 178.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -77.91 -134.48 0.78 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 119.599 -1.286 . . . . 0.0 111.832 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -84.47 90.38 7.6 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.507 178.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.67 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 84.2 mtp -95.34 -115.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.459 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -91.36 75.52 6.03 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 171.348 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.7 t -148.2 168.21 23.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.074 -1.051 . . . . 0.0 110.986 -170.013 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' H ' ' A' ' 32' ' ' TRP . 70.0 ttt180 -73.6 178.07 4.96 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.537 0.684 . . . . 0.0 110.627 -175.903 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.471 ' H ' ' HG2' ' A' ' 31' ' ' ARG . 59.1 t-105 -55.79 -60.75 3.01 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.492 -0.755 . . . . 0.0 112.826 -172.14 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -95.44 24.03 5.48 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.6 -0.84 . . . . 0.0 112.432 178.737 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.3 m0 -112.28 163.46 14.36 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.138 -0.976 . . . . 0.0 110.024 -177.414 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -125.64 168.28 13.94 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.987 -178.381 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 t -106.79 133.09 51.98 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.326 176.471 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 49.7 t -120.49 145.3 47.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 122.178 0.99 . . . . 0.0 112.083 -173.606 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.999 173.581 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 69.0 mttm . . . . . 0 N--CA 1.469 0.485 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -72.06 -50.57 27.24 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.758 -177.25 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.5 t -77.18 -29.45 54.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.652 -0.819 . . . . 0.0 112.276 -176.48 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -68.16 -36.07 79.06 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.803 -0.759 . . . . 0.0 111.524 175.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -66.22 -42.66 88.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.478 177.06 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.97 -49.58 50.27 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.011 174.734 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.82 85.24 0.58 Allowed Glycine 0 N--CA 1.465 0.629 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.3 -176.52 39.87 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.541 -1.314 . . . . 0.0 111.314 -178.806 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -143.82 138.0 28.38 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.66 -0.816 . . . . 0.0 109.377 -178.916 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.5 m -80.14 135.01 36.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.451 1.12 . . . . 0.0 111.149 179.146 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -129.22 145.57 57.26 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.056 175.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -56.37 166.16 3.69 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.686 1.591 . . . . 0.0 113.208 177.389 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -59.41 -45.46 91.48 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.675 178.438 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.84 -27.15 69.13 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -175.963 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -86.97 134.49 33.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.132 0.967 . . . . 0.0 110.369 -172.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.4 mt -112.58 124.97 69.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.001 -171.659 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.4 p -94.33 137.06 33.93 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 168.635 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.83 120.58 55.23 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.584 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -86.02 159.01 57.77 Favored 'Cis proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.236 -1.568 . . . . 0.0 112.219 9.87 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.81 -27.04 4.18 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 121.743 1.629 . . . . 0.0 113.198 -173.275 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 95.7 p -85.28 59.57 5.71 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.478 -0.764 . . . . 0.0 110.763 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.7 m -162.44 80.73 0.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.399 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -158.59 147.33 18.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.124 0.964 . . . . 0.0 110.595 -175.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.49 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 84.4 m-85 -82.05 160.23 23.27 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.481 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -121.4 0.6 Allowed Glycine 0 N--CA 1.465 0.606 0 C-N-CA 119.244 -1.455 . . . . 0.0 110.754 -175.816 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -88.29 95.89 10.36 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.445 -0.902 . . . . 0.0 108.63 177.607 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.49 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.9 mtp -86.98 -108.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.53 50.61 0.8 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.96 0.886 . . . . 0.0 110.109 174.964 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.2 m -141.41 177.97 7.75 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -177.354 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -74.02 -178.85 3.48 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.272 1.034 . . . . 0.0 112.228 -171.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -57.17 -52.58 64.73 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -172.128 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -89.82 -3.26 58.22 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.566 -0.854 . . . . 0.0 113.104 -171.749 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -99.59 147.11 25.71 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.817 -1.177 . . . . 0.0 109.469 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -124.43 155.57 38.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -174.261 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.447 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 6.5 t -99.54 114.14 26.96 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.922 -1.111 . . . . 0.0 109.762 176.881 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.1 t -86.45 144.56 27.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.241 1.019 . . . . 0.0 111.171 -174.202 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.9 tptp . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.348 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttp . . . . . 0 N--CA 1.469 0.494 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -75.12 -49.26 20.15 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.195 -0.94 . . . . 0.0 112.771 -170.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 83.7 m -62.46 -32.79 73.72 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.294 -0.878 . . . . 0.0 112.206 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -71.88 -29.86 64.8 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.163 -0.615 . . . . 0.0 112.375 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -66.11 -43.3 87.6 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.59 -0.694 . . . . 0.0 111.732 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -72.9 -36.33 67.27 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 119.499 -0.88 . . . . 0.0 111.579 176.623 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.42 57.35 0.29 Allowed Glycine 0 N--CA 1.467 0.761 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.509 175.299 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -158.02 -170.59 22.94 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 119.632 -1.27 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -142.41 161.0 39.16 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.123 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 88.1 m -79.82 144.1 33.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.089 0.947 . . . . 0.0 111.087 175.825 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -135.26 145.55 54.45 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.036 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.2 153.91 55.72 Favored 'Trans proline' 0 C--N 1.332 -0.29 0 C-N-CA 121.556 1.504 . . . . 0.0 112.284 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -84.13 79.99 9.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.243 1.02 . . . . 0.0 110.205 -176.97 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -154.23 -35.84 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.773 178.495 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -93.24 156.2 16.97 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.887 0.851 . . . . 0.0 109.69 177.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.9 mt -87.13 130.65 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.096 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.2 t -86.8 131.31 34.16 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.676 173.127 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -122.96 119.81 27.75 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -173.378 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.84 161.06 83.2 Favored 'Cis proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.423 -1.49 . . . . 0.0 111.951 6.066 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -80.07 -7.96 14.22 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 121.69 1.594 . . . . 0.0 113.499 -176.597 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -71.51 -42.82 67.51 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.443 -0.786 . . . . 0.0 111.794 -178.501 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -88.56 65.75 7.94 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 122.309 1.052 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -118.41 120.1 36.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.584 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.8 m-85 -102.6 153.09 20.44 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.746 -0.782 . . . . 0.0 109.473 -175.51 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.98 -118.86 2.15 Favored Glycine 0 N--CA 1.466 0.639 0 C-N-CA 119.391 -1.385 . . . . 0.0 111.419 -171.902 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -83.37 81.54 8.67 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.178 178.134 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.584 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 86.6 mtp -83.37 -71.52 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.083 -179.716 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.449 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 35.3 t70 -126.9 31.48 5.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.571 0.701 . . . . 0.0 109.813 178.216 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 95.0 m -150.66 178.4 9.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 122.185 0.993 . . . . 0.0 110.86 -171.936 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -77.8 -175.44 3.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 122.253 1.025 . . . . 0.0 112.162 -171.857 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.1 t-105 -63.36 -51.43 65.93 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.379 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.39 6.52 11.96 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.888 -175.46 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 14.2 m0 -121.31 156.72 31.96 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -142.96 161.72 37.38 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.144 -177.44 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 43.2 m -102.02 153.88 19.48 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 119.651 -0.819 . . . . 0.0 110.054 174.86 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -149.82 156.7 42.26 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.933 -179.951 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt . . . . . 0 C--N 1.325 -0.47 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 173.905 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 N--CA 1.467 0.379 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -77.94 -49.67 13.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 119.499 -0.881 . . . . 0.0 112.011 -177.99 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.94 -36.99 75.7 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.997 -179.301 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -74.29 -37.98 63.51 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.012 178.797 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -67.77 -38.01 82.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.946 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -64.88 -37.3 87.16 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.615 176.616 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.42 66.85 0.68 Allowed Glycine 0 N--CA 1.466 0.681 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -178.864 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.97 170.74 30.72 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 119.503 -1.332 . . . . 0.0 111.48 -176.921 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -126.94 152.01 47.71 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 176.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.8 m -80.71 135.5 36.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.167 0.984 . . . . 0.0 111.418 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.9 m-85 -139.11 143.87 38.52 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.178 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.77 163.23 2.05 Favored 'Trans proline' 0 C--N 1.331 -0.361 0 C-N-CA 121.657 1.571 . . . . 0.0 112.213 171.051 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -85.12 45.9 1.22 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.713 -174.401 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -145.41 -29.02 0.44 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -173.988 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -87.44 172.82 9.52 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.273 1.035 . . . . 0.0 111.961 -171.542 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.48 139.97 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 122.381 1.086 . . . . 0.0 110.284 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -116.12 142.65 46.53 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 168.586 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.417 ' C ' HD13 ' A' ' 19' ' ' LEU . 1.9 tm? -135.41 114.76 11.5 Favored Pre-proline 0 C--N 1.325 -0.49 0 C-N-CA 119.301 -0.96 . . . . 0.0 108.61 -174.094 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.97 158.75 96.24 Favored 'Cis proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.375 -1.511 . . . . 0.0 111.699 2.644 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.92 -27.79 0.87 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.163 1.242 . . . . 0.0 114.444 -168.953 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.5 m -94.7 59.26 2.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.15 -0.969 . . . . 0.0 111.434 -172.086 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.4 m -166.18 69.16 0.12 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 175.478 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -128.45 130.27 47.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 122.171 0.986 . . . . 0.0 110.538 -176.499 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 23.5 m-85 -86.56 170.06 12.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.22 178.426 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.03 -137.84 6.34 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 119.54 -1.314 . . . . 0.0 111.202 -178.037 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -76.22 115.3 15.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.335 177.858 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.1 mtp -119.42 -95.95 0.48 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.72 -0.792 . . . . 0.0 109.051 -175.695 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.519 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 2.9 m-20 -107.79 53.71 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.33 179.602 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.519 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 58.2 m -152.2 -163.63 1.78 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.94 -178.88 5.73 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 120.932 -1.105 . . . . 0.0 111.681 -171.674 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -58.23 -51.78 68.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -171.095 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -95.56 7.55 45.92 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.614 -0.834 . . . . 0.0 113.191 -170.156 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -104.05 162.09 13.44 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.117 -0.989 . . . . 0.0 109.781 -178.538 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -132.66 167.3 20.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.971 -174.683 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.578 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 43.2 t -114.28 106.9 14.89 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.653 -174.093 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 t -92.65 148.4 22.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.161 -1.016 . . . . 0.0 111.801 -174.714 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--N 1.326 -0.434 0 CA-C-O 121.893 0.854 . . . . 0.0 109.098 178.942 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 120.949 0.404 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -77.46 -40.98 41.3 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.0 -176.172 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 10.5 t -73.1 -28.28 62.18 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.673 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -67.34 -28.78 68.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -174.6 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -54.88 -43.71 73.41 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 119.539 -0.865 . . . . 0.0 110.877 171.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -74.86 -48.99 22.09 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.723 173.17 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.28 84.5 1.18 Allowed Glycine 0 N--CA 1.467 0.729 0 C-N-CA 120.277 -0.963 . . . . 0.0 110.853 178.273 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.73 163.82 32.83 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 119.135 -1.507 . . . . 0.0 112.616 -176.68 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -120.83 154.93 35.11 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.651 0.739 . . . . 0.0 109.305 177.611 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.7 m -80.53 139.14 36.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.258 1.028 . . . . 0.0 111.574 -178.156 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -142.59 158.57 59.88 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 172.791 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.51 175.56 2.72 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 121.475 1.45 . . . . 0.0 113.395 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -93.39 75.46 4.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.614 0.721 . . . . 0.0 110.459 -176.229 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -169.29 -32.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.422 -177.436 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -85.47 172.18 11.2 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.55 1.167 . . . . 0.0 112.088 -173.221 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -87.74 134.01 28.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.816 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.65 105.25 17.36 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 171.529 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HA ' ' C ' ' A' ' 20' ' ' PRO . 23.9 tp -118.75 132.52 23.85 Favored Pre-proline 0 N--CA 1.469 0.48 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.173 -169.313 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.439 ' C ' ' HA ' ' A' ' 19' ' ' LEU . 62.2 Cg_exo -66.3 167.66 52.73 Favored 'Cis proline' 0 CA--C 1.532 0.411 0 CA-C-N 120.988 1.388 . . . . 0.0 114.0 4.427 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.81 75.16 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 121.444 1.429 . . . . 0.0 111.122 -169.076 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.2 p -140.05 -66.35 0.45 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.511 -177.917 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.9 m -99.39 81.95 2.6 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.713 0.768 . . . . 0.0 111.27 -172.474 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -106.61 118.08 35.74 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 172.505 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -95.7 153.74 17.57 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.7 -176.401 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.49 -122.77 1.97 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 119.667 -1.254 . . . . 0.0 111.363 -177.072 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -75.69 99.64 4.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 119.219 -0.992 . . . . 0.0 109.12 175.793 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 90.1 mmm -99.43 -120.39 0.15 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 176.201 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -103.62 40.77 1.37 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.089 -1.045 . . . . 0.0 110.714 170.218 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.9 m -93.97 -165.47 1.33 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 170.341 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -86.04 -171.21 3.46 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.752 -1.218 . . . . 0.0 109.918 176.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -59.47 -45.59 91.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -170.021 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -107.82 15.93 24.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -173.778 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -111.77 172.77 6.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.115 -0.991 . . . . 0.0 110.404 178.062 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -135.89 171.03 15.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.153 -0.619 . . . . 0.0 111.003 -174.919 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.3 t -113.71 143.42 44.64 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.787 -0.57 . . . . 0.0 109.94 177.164 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 19.5 t -125.26 143.2 51.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.851 0.834 . . . . 0.0 111.444 -175.924 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.1 tttt . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 173.252 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 47.4 p90 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -79.89 -55.21 5.14 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.169 -0.957 . . . . 0.0 111.736 -170.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -76.72 -47.85 20.61 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.502 -0.749 . . . . 0.0 112.082 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -64.03 -40.27 95.96 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -172.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -66.95 -29.39 69.24 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -70.96 -48.78 51.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.763 -0.586 . . . . 0.0 112.549 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.88 -50.13 25.67 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.264 -0.898 . . . . 0.0 112.182 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.79 69.1 0.06 OUTLIER Glycine 0 N--CA 1.469 0.838 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.95 163.92 37.09 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.304 -176.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -137.49 144.03 42.02 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 92.9 m -78.77 133.57 37.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.151 0.977 . . . . 0.0 111.44 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -139.86 146.87 48.94 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.62 152.95 15.31 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.641 1.56 . . . . 0.0 112.527 171.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -23.61 60.98 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -89.45 -23.53 22.09 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -79.63 155.7 27.98 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.238 1.018 . . . . 0.0 111.583 -173.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.64 130.54 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 122.19 0.995 . . . . 0.0 112.049 -173.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.4 t -108.94 139.15 44.19 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 166.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.2 111.31 12.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.67 159.38 96.71 Favored 'Cis proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.957 7.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -86.04 -38.11 0.1 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 121.341 1.361 . . . . 0.0 114.904 -168.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.2 t -93.6 62.43 3.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.934 0.873 . . . . 0.0 111.859 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.6 p -162.53 98.27 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -150.39 141.86 23.42 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.781 1.277 . . . . 0.0 113.259 -170.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.496 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 62.5 m-85 -94.27 159.92 14.91 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.141 169.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.15 -124.95 2.52 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.378 -175.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.85 77.45 10.09 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.644 1.211 . . . . 0.0 110.281 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.653 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 96.4 mtp -73.42 -64.02 1.07 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.183 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.477 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 30.1 t70 -138.44 44.5 2.1 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.666 0.746 . . . . 0.0 109.367 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 86.5 m -153.35 -176.81 5.96 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.92 0.867 . . . . 0.0 110.76 -171.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -79.84 -177.68 6.06 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.245 1.021 . . . . 0.0 112.754 -170.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -60.89 -56.86 16.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -77.12 -4.41 44.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -175.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -108.58 153.01 23.98 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.166 -0.959 . . . . 0.0 109.334 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -140.19 153.56 46.65 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.641 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 35.7 m -91.07 124.22 35.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.246 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.0 t -79.15 155.88 28.49 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.304 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -114.69 129.15 56.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.501 0.667 . . . . 0.0 110.895 -169.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -145.96 -63.54 0.32 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.042 173.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.92 0.94 Allowed Glycine 0 N--CA 1.469 0.873 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.308 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.6 p -85.36 64.46 8.67 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.63 -0.924 . . . . 0.0 111.816 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 C-N-CA 120.279 -0.963 . . . . 0.0 111.898 173.819 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 83.1 t80 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -75.75 -60.44 2.32 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.21 -0.931 . . . . 0.0 112.369 -172.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.408 ' OE1' ' SD ' ' A' ' 28' ' ' MET . 46.0 tt0 -76.67 -44.62 33.07 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.382 -0.824 . . . . 0.0 112.995 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -66.15 -38.6 88.52 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.797 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -63.31 -31.12 72.18 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -62.96 -44.17 96.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.838 -0.539 . . . . 0.0 112.156 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -70.65 -45.88 64.31 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.495 -0.753 . . . . 0.0 111.737 172.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.77 83.93 0.9 Allowed Glycine 0 N--CA 1.468 0.781 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.06 -166.58 24.26 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 119.577 -1.296 . . . . 0.0 112.222 -175.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -147.05 152.15 38.07 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.761 0.791 . . . . 0.0 108.986 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.1 m -79.8 123.99 28.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.054 -0.658 . . . . 0.0 110.177 175.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 37' ' ' CYS . 96.9 m-85 -126.35 148.36 63.6 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 175.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.13 156.66 19.7 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 121.592 1.528 . . . . 0.0 112.08 171.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -62.4 -31.16 71.8 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -99.25 -23.1 15.31 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -89.7 -161.22 0.76 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.529 -0.732 . . . . 0.0 111.75 -168.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.0 mt -79.1 139.19 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 122.707 1.242 . . . . 0.0 112.774 -169.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.2 t -116.02 144.48 44.05 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 166.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -141.65 110.58 6.23 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 119.461 -0.896 . . . . 0.0 108.866 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.99 154.4 87.81 Favored 'Cis proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.531 -1.445 . . . . 0.0 111.622 0.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -77.68 -33.53 2.27 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 121.273 1.315 . . . . 0.0 115.123 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.6 m -93.18 66.06 4.01 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.384 -0.823 . . . . 0.0 111.044 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.495 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 55.4 m -163.74 74.64 0.33 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -101.33 141.85 33.59 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.548 1.166 . . . . 0.0 111.521 -172.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -117.59 152.45 35.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.031 175.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -76.03 -148.19 2.24 Favored Glycine 0 N--CA 1.47 0.967 0 C-N-CA 119.684 -1.246 . . . . 0.0 112.894 -173.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -81.11 95.29 6.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.815 1.293 . . . . 0.0 108.874 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.656 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 25.4 mmm -98.48 -74.52 0.58 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.844 -171.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -146.58 61.3 1.21 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 74.0 m -129.97 -103.0 0.3 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -149.27 -171.55 3.91 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.398 -0.814 . . . . 0.0 109.203 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -60.16 -55.98 27.22 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -171.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -94.41 10.83 32.84 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -109.85 164.74 12.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.445 1.117 . . . . 0.0 110.082 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -130.21 159.39 37.0 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.17 -176.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 43.9 m -90.01 157.08 17.98 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.102 -1.039 . . . . 0.0 108.768 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 23' ' ' SER . 11.1 t -158.23 -178.83 7.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.894 0.854 . . . . 0.0 109.105 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -78.06 140.33 39.11 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.829 0.823 . . . . 0.0 110.227 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.608 ' H ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -74.94 -47.49 29.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 -170.184 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.35 65.29 0.29 Allowed Glycine 0 N--CA 1.47 0.933 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.118 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.7 p -161.61 -51.25 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 109.77 175.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.198 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 178.332 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 71.1 t80 . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.123 0.487 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -173.81 -71.92 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.46 169.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -79.0 -55.51 5.07 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.719 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 77.8 m -62.98 -29.11 70.56 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.06 -29.55 67.7 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.303 -0.873 . . . . 0.0 112.494 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -58.7 -50.77 72.65 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.653 -0.655 . . . . 0.0 111.46 173.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.0 -47.11 81.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.303 172.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 103.61 55.84 0.78 Allowed Glycine 0 N--CA 1.468 0.791 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.466 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.69 -152.29 7.69 Favored Glycine 0 N--CA 1.468 0.803 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -150.47 148.72 29.07 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.17 0.986 . . . . 0.0 109.992 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.5 t -80.92 113.81 19.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.785 0.802 . . . . 0.0 110.786 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -124.73 157.65 65.18 Favored Pre-proline 0 N--CA 1.471 0.579 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.556 178.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -58.77 157.88 26.5 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.849 1.7 . . . . 0.0 113.793 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -63.27 -27.85 69.62 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.91 -30.37 58.75 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -74.48 154.48 38.69 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.228 1.013 . . . . 0.0 111.197 -171.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.0 mt -79.47 124.48 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 122.022 0.915 . . . . 0.0 111.077 -169.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.418 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 49.4 t -95.49 140.51 30.24 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 169.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.21 119.31 29.67 Favored Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.03 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 166.77 82.06 Favored 'Cis proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.402 -1.499 . . . . 0.0 111.419 1.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -51.36 -49.81 15.95 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 122.098 1.865 . . . . 0.0 115.464 -172.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.9 p -92.58 56.73 2.77 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.638 0.732 . . . . 0.0 111.818 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.8 m -145.34 69.89 1.25 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 122.426 1.108 . . . . 0.0 109.574 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.418 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 5.1 p30 -144.27 151.42 39.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.083 0.944 . . . . 0.0 109.12 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.625 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 36.1 m-85 -98.04 170.2 9.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.608 0.718 . . . . 0.0 109.07 175.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.08 -142.82 3.47 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.673 -1.251 . . . . 0.0 112.441 -171.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -79.16 81.98 5.37 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.782 1.277 . . . . 0.0 109.57 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.719 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 95.1 mtp -82.17 -111.02 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.466 -178.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -91.24 64.13 5.14 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 t -142.64 169.71 17.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -169.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 51.0 ttt85 -67.75 166.44 15.31 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.321 -0.862 . . . . 0.0 110.753 -177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -51.29 -46.84 62.62 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -108.88 28.23 8.67 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.238 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -111.51 168.91 9.18 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.301 -0.874 . . . . 0.0 109.347 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -135.46 149.1 49.47 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.484 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.7 m -89.48 114.91 26.48 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.803 0.811 . . . . 0.0 109.56 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 50.0 t -84.98 126.77 33.8 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.944 0.878 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -161.08 129.89 4.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -176.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -75.61 172.37 12.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 122.543 1.163 . . . . 0.0 111.827 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.75 -62.06 1.89 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 119.979 -1.105 . . . . 0.0 110.44 171.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.9 p -90.78 73.04 6.64 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.129 0.966 . . . . 0.0 109.674 173.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.156 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 t80 . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -123.08 167.5 13.58 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.412 1.101 . . . . 0.0 113.139 -168.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -68.75 -52.22 32.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.175 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.0 t -68.21 -29.54 68.41 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.351 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -68.76 -30.14 68.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.908 174.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -67.01 -36.24 81.7 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -82.47 -53.32 6.08 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.004 174.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.64 81.83 0.14 Allowed Glycine 0 N--CA 1.467 0.708 0 C-N-CA 119.992 -1.099 . . . . 0.0 110.582 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.75 170.33 40.5 Favored Glycine 0 N--CA 1.468 0.773 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.98 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -132.03 155.02 48.76 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.2 m -81.29 136.57 35.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.814 0.816 . . . . 0.0 112.282 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -134.1 149.63 72.02 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.05 173.49 0.9 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 121.885 1.724 . . . . 0.0 114.019 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.25 -48.9 16.3 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.524 -0.735 . . . . 0.0 111.487 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -29.88 70.95 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -86.42 137.52 32.49 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.727 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.4 mt -100.5 133.55 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 CA-C-O 121.795 0.807 . . . . 0.0 110.813 -170.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 p -102.39 149.51 24.29 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.4 tp -117.61 131.06 24.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -174.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.7 160.54 90.67 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.207 1.467 . . . . 0.0 113.363 5.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -85.19 -30.6 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 121.254 1.303 . . . . 0.0 113.996 -169.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.5 m -93.45 52.62 1.76 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.312 -0.868 . . . . 0.0 110.771 178.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -150.23 77.88 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.65 0.738 . . . . 0.0 109.193 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -157.95 158.9 35.85 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.311 1.053 . . . . 0.0 111.245 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.446 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 57.7 m-85 -99.66 170.04 8.85 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.342 -0.845 . . . . 0.0 109.645 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.09 -133.76 4.39 Favored Glycine 0 N--CA 1.47 0.902 0 C-N-CA 119.806 -1.188 . . . . 0.0 112.907 -170.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -84.92 86.88 7.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.16 0.981 . . . . 0.0 108.471 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.446 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 74.1 mtp -84.5 -76.26 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.894 -171.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -128.72 12.02 6.26 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 79.9 m -114.1 -157.78 0.64 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.62 -0.675 . . . . 0.0 109.578 178.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -78.88 -178.87 6.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.377 1.084 . . . . 0.0 111.92 -171.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -63.51 -49.06 75.02 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -176.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -91.22 18.54 6.84 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -113.84 156.17 24.4 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -135.17 157.2 47.52 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.081 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.5 t -98.39 107.93 20.51 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.808 -176.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.0 t -97.33 148.64 22.93 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.284 1.04 . . . . 0.0 111.571 -172.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -141.56 137.57 32.06 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.909 176.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -94.28 -68.98 0.77 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.897 0.856 . . . . 0.0 110.367 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.32 -73.8 0.06 OUTLIER Glycine 0 N--CA 1.466 0.658 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 -177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.4 m -85.16 59.84 5.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 108.68 168.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.149 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.998 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 55.1 t80 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -84.19 -58.77 2.63 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 119.68 -0.808 . . . . 0.0 112.06 -169.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.19 -49.88 14.19 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.342 -173.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.6 t -77.36 -28.65 53.0 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -70.77 -33.84 71.18 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.135 -0.978 . . . . 0.0 112.832 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -76.91 -39.36 51.13 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.726 -0.609 . . . . 0.0 111.629 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -71.75 -35.63 70.17 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.498 -0.751 . . . . 0.0 112.299 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.22 90.66 2.0 Favored Glycine 0 N--CA 1.47 0.934 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.824 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.1 146.25 9.78 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 119.52 -1.324 . . . . 0.0 112.324 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -101.57 143.8 31.11 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 175.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HE3' ' A' ' 34' ' ' TRP . 42.3 t -85.54 131.32 34.39 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.361 -0.837 . . . . 0.0 111.864 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -132.73 154.08 81.32 Favored Pre-proline 0 N--CA 1.471 0.62 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.79 163.47 15.91 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.836 1.69 . . . . 0.0 111.599 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.67 -4.62 16.3 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.33 -21.16 42.78 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -87.16 152.26 22.48 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.028 0.918 . . . . 0.0 112.57 -169.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -83.2 135.92 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 121.822 0.82 . . . . 0.0 109.05 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -96.09 119.16 34.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.726 0.774 . . . . 0.0 110.509 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.7 tp -121.35 134.36 24.47 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.88 168.33 76.85 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 123.676 -1.385 . . . . 0.0 111.72 2.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -58.53 -51.07 7.97 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.606 1.537 . . . . 0.0 114.777 -170.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 70.5 m -90.5 58.91 4.12 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.616 0.722 . . . . 0.0 111.468 -177.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.9 m -162.48 83.2 0.54 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.14 0.971 . . . . 0.0 108.672 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -157.33 160.8 38.87 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.61 0.719 . . . . 0.0 109.104 -171.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.9 m-85 -135.54 163.96 28.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.816 0.817 . . . . 0.0 110.14 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.05 -143.31 5.65 Favored Glycine 0 N--CA 1.47 0.911 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.093 -176.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -77.68 98.4 5.46 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.317 1.055 . . . . 0.0 109.016 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.554 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 85.2 mtp -90.19 -113.63 0.07 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.584 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -110.62 68.64 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.8 t -142.26 -88.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -141.47 155.37 45.84 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -55.85 -34.15 65.17 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -109.49 15.34 23.04 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.42 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 33.0 m0 -113.4 161.57 17.14 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.058 -1.026 . . . . 0.0 109.505 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -113.42 170.95 7.87 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.362 0.601 . . . . 0.0 110.364 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.9 t -119.92 97.15 5.47 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.443 -0.785 . . . . 0.0 109.174 173.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.41 ' SG ' ' HD2' ' A' ' 39' ' ' LYS . 43.3 t -86.12 150.54 24.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.768 0.794 . . . . 0.0 111.545 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -97.25 90.98 5.3 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.7 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HD2' ' SG ' ' A' ' 37' ' ' CYS . 20.8 ptmt -152.11 -145.36 0.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.248 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.54 -82.47 0.27 Allowed Glycine 0 N--CA 1.468 0.811 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 72.2 m -136.29 98.11 3.76 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -178.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.194 0 C-N-CA 119.357 -1.401 . . . . 0.0 112.37 179.806 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -87.19 -78.26 0.31 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.37 -0.832 . . . . 0.0 111.291 -171.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -77.38 -47.89 18.7 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.563 -0.71 . . . . 0.0 112.47 -174.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.7 t -62.99 -30.29 71.48 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -76.96 -38.09 53.94 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.459 -0.776 . . . . 0.0 112.092 174.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -69.82 -42.48 73.6 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.593 -0.692 . . . . 0.0 112.504 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -71.69 -63.02 1.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.316 -0.865 . . . . 0.0 111.235 177.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.84 83.7 0.05 OUTLIER Glycine 0 N--CA 1.467 0.723 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.627 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.19 163.76 37.43 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.664 -1.255 . . . . 0.0 111.242 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -123.78 147.28 47.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.6 m -78.47 125.28 29.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.755 0.788 . . . . 0.0 110.716 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -132.98 156.56 79.95 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.8 136.72 77.97 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.898 1.732 . . . . 0.0 112.294 175.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -76.87 -29.59 55.87 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -172.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.13 -28.26 69.94 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 172.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -81.52 144.76 31.09 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.096 0.95 . . . . 0.0 109.279 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -87.71 133.92 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.864 0.84 . . . . 0.0 111.203 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 57.7 m -74.67 131.08 40.59 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 168.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.51 116.58 31.94 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.79 163.49 85.88 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.482 -1.466 . . . . 0.0 112.56 7.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -72.01 -27.06 17.75 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.892 1.728 . . . . 0.0 113.834 -175.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.3 p -71.1 -28.92 64.66 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.51 -0.744 . . . . 0.0 112.804 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -84.46 81.9 8.64 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.483 -0.761 . . . . 0.0 109.395 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -150.29 130.38 13.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 122.575 1.179 . . . . 0.0 111.058 -173.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.613 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 26.9 m-85 -106.4 152.24 23.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.327 173.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.56 -133.92 3.67 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.914 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -80.52 83.89 6.23 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.754 1.264 . . . . 0.0 110.213 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.613 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 94.1 mtp -81.17 -69.1 0.63 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.857 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -151.72 57.65 0.86 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 84.9 m -123.32 -105.36 0.36 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -155.17 -169.21 3.1 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.349 -0.844 . . . . 0.0 109.114 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 45.7 t-105 -60.99 -51.76 67.88 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.31 -0.869 . . . . 0.0 112.987 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -85.58 -0.07 53.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -120.23 150.92 39.91 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.803 1.183 . . . . 0.0 109.767 -177.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -134.21 177.21 7.92 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.132 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -103.46 136.76 42.6 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.076 -1.015 . . . . 0.0 110.951 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 79.6 m -84.49 142.05 30.33 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -88.94 146.61 24.8 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.019 0.914 . . . . 0.0 110.391 -176.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -0.93 23.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.637 1.718 . . . . 0.0 115.637 -172.084 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.25 -112.12 0.5 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 119.538 -1.315 . . . . 0.0 110.954 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.0 t -75.52 -87.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.803 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.142 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.82 176.208 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 79.2 t80 . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -59.92 -56.38 22.47 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -78.49 -44.5 24.32 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.39 -40.75 95.49 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -71.32 -36.43 71.58 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.635 -0.666 . . . . 0.0 112.213 176.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -67.64 -38.04 83.29 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -72.39 -51.75 19.04 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.178 -0.952 . . . . 0.0 111.629 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.58 72.91 0.03 OUTLIER Glycine 0 N--CA 1.467 0.752 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.113 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.52 -174.16 42.76 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 119.522 -1.323 . . . . 0.0 112.24 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -143.82 153.06 41.98 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.03 119.12 21.71 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.986 0.898 . . . . 0.0 110.773 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.89 152.38 75.24 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -60.03 168.93 5.3 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 121.49 1.46 . . . . 0.0 113.882 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -58.73 -51.39 70.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.373 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.0 -26.97 69.1 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.05 134.33 42.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 122.162 0.982 . . . . 0.0 109.969 176.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.1 mt -85.19 132.24 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-O 121.821 0.82 . . . . 0.0 111.356 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 94.0 m -78.23 136.52 37.8 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.8 117.93 30.84 Favored Pre-proline 0 N--CA 1.469 0.505 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.406 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 59.1 Cg_endo -80.32 166.24 76.48 Favored 'Cis proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.269 -1.555 . . . . 0.0 112.846 8.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 74.1 Cg_exo -59.35 -39.49 76.68 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 121.922 1.748 . . . . 0.0 115.102 -173.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -90.06 59.43 4.5 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.976 0.893 . . . . 0.0 110.823 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.3 t -161.27 85.75 0.67 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.444 ' OD1' ' SG ' ' A' ' 18' ' ' CYS . 27.8 t70 -157.23 126.68 6.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.743 -0.783 . . . . 0.0 109.572 -169.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -83.12 154.03 24.53 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.77 -129.87 1.16 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 119.68 -1.248 . . . . 0.0 112.092 -174.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -84.23 94.97 8.53 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.784 0.802 . . . . 0.0 108.981 177.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 40.9 mmm -89.5 -77.52 0.38 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.994 -172.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -145.86 43.85 1.26 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.777 0.799 . . . . 0.0 111.454 -176.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 88.5 m -134.11 -151.21 0.43 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -83.04 -178.61 7.18 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.622 -1.299 . . . . 0.0 111.567 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.1 t-105 -57.95 -54.09 50.91 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -92.98 25.26 3.28 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -114.16 154.89 27.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 122.394 1.092 . . . . 0.0 110.012 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -120.29 164.1 16.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.965 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.6 t -110.85 112.19 23.87 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 169.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -78.62 143.8 36.06 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.238 -173.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -114.12 142.98 45.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.929 174.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' H ' ' CD ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -76.52 178.81 6.35 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.898 0.856 . . . . 0.0 111.799 176.495 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -94.75 -116.88 2.92 Favored Glycine 0 N--CA 1.47 0.915 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.573 -173.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.5 m -86.04 74.53 10.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.12 0.962 . . . . 0.0 110.708 -175.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 179.327 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 41.9 p90 . . . . . 0 N--CA 1.475 0.798 0 CA-C-O 122.345 1.069 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -132.32 -69.84 0.58 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.591 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -78.19 -49.48 13.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.3 t -68.0 -33.66 75.04 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.439 -0.904 . . . . 0.0 113.199 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.06 -30.51 70.59 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.028 -0.669 . . . . 0.0 112.751 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -66.4 -44.34 83.28 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.908 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.58 -50.43 11.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.748 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.25 92.27 0.44 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 120.022 -1.085 . . . . 0.0 110.85 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.99 172.13 42.11 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.954 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -130.87 143.31 50.64 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 m -78.16 128.56 33.97 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.343 1.068 . . . . 0.0 110.967 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -132.14 147.35 65.45 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.98 149.2 63.43 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 121.411 1.407 . . . . 0.0 112.213 175.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.93 -29.43 69.61 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -64.31 -25.06 67.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -79.06 150.48 31.86 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.481 -0.762 . . . . 0.0 110.374 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -78.42 113.42 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 122.055 0.931 . . . . 0.0 110.643 -173.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 42.5 t -85.43 124.49 32.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 169.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -125.81 116.57 24.39 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.42 163.7 89.69 Favored 'Cis proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.44 -1.483 . . . . 0.0 112.019 5.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.62 -29.82 60.65 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.97 1.78 . . . . 0.0 114.25 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 93.1 p -96.93 50.46 1.1 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.576 -0.703 . . . . 0.0 111.803 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 92.1 p -152.11 78.53 1.23 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.371 1.082 . . . . 0.0 109.626 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.4 p30 -156.84 158.14 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 122.192 0.996 . . . . 0.0 108.827 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.449 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 88.3 m-85 -91.53 174.01 7.59 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 170.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -137.73 5.69 Favored Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.313 -1.422 . . . . 0.0 111.09 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -79.48 97.98 6.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.942 0.877 . . . . 0.0 108.874 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 61.2 mtp -89.34 -121.4 0.05 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.114 -172.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.54 48.51 1.15 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.369 -0.832 . . . . 0.0 110.808 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 99.8 m -131.53 -93.39 0.39 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -157.54 -176.1 5.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.824 -1.173 . . . . 0.0 112.482 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -60.39 -55.46 33.25 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -90.55 23.36 3.05 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -175.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -119.93 142.75 48.45 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.099 -1.001 . . . . 0.0 109.474 177.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -113.88 157.96 21.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.683 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.402 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 4.3 t -100.51 107.13 18.75 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.955 174.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 46.4 t -81.5 142.81 32.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 122.143 0.973 . . . . 0.0 111.095 -172.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -131.2 95.44 3.79 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -82.45 163.93 21.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.542 1.163 . . . . 0.0 113.148 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -107.01 -62.13 0.58 Allowed Glycine 0 CA--C 1.529 0.936 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.38 170.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.0 m -151.58 96.37 2.25 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.646 0.736 . . . . 0.0 109.563 175.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 C-N-CA 120.143 -1.027 . . . . 0.0 110.632 176.517 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 59.5 t80 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.44 -80.32 0.33 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.777 -0.769 . . . . 0.0 110.454 -177.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -78.4 -51.65 9.73 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -171.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.6 t -65.97 -29.96 70.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -76.03 -32.46 59.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.489 -0.757 . . . . 0.0 112.567 175.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -68.39 -45.35 72.93 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.83 -0.544 . . . . 0.0 112.065 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -78.54 -28.44 46.1 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.638 -0.663 . . . . 0.0 112.579 176.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.99 60.83 0.71 Allowed Glycine 0 N--CA 1.468 0.822 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.372 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.6 157.07 17.99 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -107.51 140.01 41.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.11 129.96 35.0 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.631 0.729 . . . . 0.0 111.096 -177.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -141.55 159.83 58.94 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -63.32 144.14 90.66 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 121.736 1.624 . . . . 0.0 112.737 176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -73.9 -55.09 6.6 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.468 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.15 -30.51 70.43 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -92.67 169.66 10.33 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 122.14 0.971 . . . . 0.0 109.968 174.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.6 mt -74.67 124.67 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 121.518 -0.739 . . . . 0.0 111.187 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -100.15 144.44 29.17 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 169.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -119.33 117.82 32.88 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.72 162.65 74.78 Favored 'Cis proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.641 9.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -88.34 -55.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 121.128 1.219 . . . . 0.0 113.398 -169.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 97.3 p -85.6 48.9 1.66 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.601 -0.687 . . . . 0.0 112.574 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 79.0 p -167.81 72.51 0.11 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -134.87 153.7 51.95 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.9 1.333 . . . . 0.0 112.513 -169.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.515 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 73.3 m-85 -94.7 164.31 13.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.938 173.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.29 -138.85 5.76 Favored Glycine 0 N--CA 1.468 0.832 0 C-N-CA 119.987 -1.101 . . . . 0.0 112.029 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -82.22 90.09 6.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.962 0.887 . . . . 0.0 108.892 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.515 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 88.6 mtp -86.01 -86.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -175.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -140.72 50.6 1.66 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 122.052 0.93 . . . . 0.0 109.223 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 85.9 m -98.98 -90.92 0.29 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -150.21 -179.88 7.54 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -57.99 -54.85 42.22 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.826 -1.171 . . . . 0.0 113.332 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -94.96 11.78 30.68 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -105.94 162.84 13.23 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 120.364 -1.46 . . . . 0.0 111.209 -174.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 61.2 pttt -144.12 171.87 13.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.164 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.3 m -104.1 145.93 29.47 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.099 -1.0 . . . . 0.0 110.587 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -130.47 155.68 46.05 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.475 -0.766 . . . . 0.0 109.999 173.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -142.29 143.39 32.79 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.3 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -113.6 -162.1 0.79 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.331 0.586 . . . . 0.0 110.407 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.17 -67.59 2.01 Favored Glycine 0 N--CA 1.471 0.986 0 O-C-N 121.193 -0.942 . . . . 0.0 114.026 -174.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 t -90.72 69.1 6.57 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.737 0.78 . . . . 0.0 111.224 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.139 0 CA-C-O 118.449 -1.195 . . . . 0.0 111.756 178.132 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 52.6 p90 . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -95.17 -71.73 0.66 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.146 -0.971 . . . . 0.0 111.609 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.494 ' NE2' ' SD ' ' A' ' 28' ' ' MET . 20.0 tt0 -78.31 -48.33 15.9 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -171.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.31 -39.65 89.46 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -70.54 -37.18 74.03 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -67.73 -43.6 79.58 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.444 -0.785 . . . . 0.0 112.585 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.99 -50.59 40.03 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.951 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.79 72.56 0.07 OUTLIER Glycine 0 N--CA 1.467 0.748 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.933 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.98 152.52 17.48 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 119.533 -1.317 . . . . 0.0 111.484 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -109.23 152.16 25.55 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.751 0.786 . . . . 0.0 109.577 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -79.87 126.18 30.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.17 0.986 . . . . 0.0 111.539 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -130.59 146.56 62.36 Favored Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.22 172.62 2.37 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 121.587 1.525 . . . . 0.0 113.106 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -68.2 -41.25 81.65 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 1.6 pm0 -75.88 -25.49 56.17 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -70.24 138.9 52.06 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 122.084 0.945 . . . . 0.0 110.091 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.8 mt -78.82 120.98 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 122.143 0.973 . . . . 0.0 110.642 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 43.5 t -85.65 126.3 33.82 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 169.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.27 116.5 30.94 Favored Pre-proline 0 N--CA 1.469 0.496 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -172.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.46 162.44 90.51 Favored 'Cis proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.464 5.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -70.14 -32.05 17.73 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.929 1.752 . . . . 0.0 114.132 -172.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.4 m -91.63 60.2 3.96 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.017 175.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -165.99 71.01 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.968 0.89 . . . . 0.0 109.206 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.488 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 3.3 p30 -154.56 151.61 29.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.837 0.827 . . . . 0.0 108.968 178.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -93.02 174.19 7.36 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.601 -0.84 . . . . 0.0 108.901 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.24 -134.79 3.77 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 119.748 -1.215 . . . . 0.0 110.936 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.65 123.76 25.45 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.494 ' SD ' ' NE2' ' A' ' 3' ' ' GLN . 78.8 mmm -117.98 -95.39 0.48 Allowed 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.249 -170.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -130.55 54.66 1.87 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 122.058 0.932 . . . . 0.0 109.852 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.6 m -144.85 -77.8 0.2 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.161 -0.615 . . . . 0.0 109.62 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -145.46 164.35 31.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.735 0.779 . . . . 0.0 109.539 -173.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -61.62 -49.37 76.85 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -102.31 30.57 4.47 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -114.24 154.37 28.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.121 -0.987 . . . . 0.0 109.051 175.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -114.93 160.57 19.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.913 0.863 . . . . 0.0 111.58 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.72 103.78 13.14 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 44.4 t -79.66 148.61 31.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 122.211 1.005 . . . . 0.0 111.282 -172.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -84.11 111.86 19.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.787 0.803 . . . . 0.0 109.665 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -118.5 -44.48 2.66 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.469 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.59 -97.3 0.13 Allowed Glycine 0 N--CA 1.466 0.646 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.3 t -152.68 79.25 1.21 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.752 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.187 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.806 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 71.2 t80 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -91.65 -72.29 0.59 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.289 -169.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -78.77 -50.19 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -175.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.85 -36.03 81.92 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -75.94 -32.69 59.67 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 112.693 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -66.26 -42.36 88.64 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.73 -0.606 . . . . 0.0 112.072 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -69.33 -48.35 61.67 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.579 -0.849 . . . . 0.0 110.66 171.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.72 92.88 1.41 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -174.52 170.31 43.4 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 118.912 -1.613 . . . . 0.0 112.709 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -131.0 153.63 49.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 99.2 m -79.42 120.49 23.9 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 122.069 0.937 . . . . 0.0 110.992 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -116.81 154.28 49.44 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 171.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -60.97 172.55 2.91 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 121.393 1.395 . . . . 0.0 113.94 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -62.39 -44.78 95.63 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.84 -27.28 69.06 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -174.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -75.55 141.17 43.02 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.295 1.045 . . . . 0.0 111.26 -170.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.1 mt -81.51 133.46 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 121.948 0.88 . . . . 0.0 109.611 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 23' ' ' SER . 35.4 t -84.56 133.07 34.45 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.62 115.17 13.45 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -176.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -74.47 164.33 88.23 Favored 'Cis proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.309 -1.538 . . . . 0.0 111.947 4.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.51 -13.95 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 121.767 1.644 . . . . 0.0 114.48 -171.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 48.2 m -71.22 -24.0 62.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 177.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 69.0 m -100.42 50.02 0.9 Allowed 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.673 -0.642 . . . . 0.0 111.574 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -101.94 100.13 10.39 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 24.8 m-85 -99.28 159.6 14.88 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.571 -174.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.15 -144.94 2.48 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 119.717 -1.23 . . . . 0.0 112.121 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -82.2 74.72 9.16 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.449 1.119 . . . . 0.0 110.577 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.55 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 95.6 mtp -71.18 -79.61 0.07 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.505 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.05 52.95 0.72 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 169.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.2 m -132.52 173.39 11.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.802 0.811 . . . . 0.0 109.946 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -79.96 -165.78 0.89 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.4 t-105 -52.48 -64.27 0.87 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -101.51 16.58 25.23 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -98.09 160.16 14.48 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.532 -1.355 . . . . 0.0 110.821 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -124.76 141.31 52.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.641 -169.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.35 122.42 30.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.9 t -128.35 144.58 51.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.618 0.723 . . . . 0.0 110.159 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -101.87 102.17 12.71 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.513 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.496 ' H ' ' HD3' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -81.51 -28.71 33.9 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 178.78 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -146.74 -102.78 0.32 Allowed Glycine 0 N--CA 1.467 0.744 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 178.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.8 p -86.06 -45.46 11.39 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.861 -0.735 . . . . 0.0 111.425 176.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 178.638 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 68.9 t80 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -60.15 -55.66 31.11 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.504 -0.748 . . . . 0.0 112.351 -171.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.42 -46.99 18.51 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.995 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.1 t -72.14 -29.15 63.77 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -64.99 -29.14 70.04 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.274 -0.891 . . . . 0.0 112.49 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -55.71 -45.26 77.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.432 -0.507 . . . . 0.0 111.937 173.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -76.88 -45.23 28.94 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.545 -0.722 . . . . 0.0 111.184 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.91 64.94 0.29 Allowed Glycine 0 N--CA 1.469 0.894 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.336 173.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.46 158.44 28.97 Favored Glycine 0 N--CA 1.467 0.761 0 C-N-CA 119.613 -1.279 . . . . 0.0 111.745 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -102.77 158.97 15.88 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.629 0.728 . . . . 0.0 109.759 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.0 m -79.34 138.58 37.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.106 0.955 . . . . 0.0 110.858 177.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.92 159.09 72.46 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -59.24 141.68 98.19 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.78 1.653 . . . . 0.0 113.237 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -72.06 -45.0 62.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.061 -0.655 . . . . 0.0 112.49 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.35 -28.78 67.15 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -174.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -94.36 158.64 15.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.196 0.998 . . . . 0.0 110.349 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.0 mt -83.89 132.67 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-O 121.817 0.817 . . . . 0.0 110.437 -172.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.34 137.57 32.21 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 169.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -115.44 118.57 39.35 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 72.0 Cg_endo -84.39 161.66 67.75 Favored 'Cis proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.425 -1.489 . . . . 0.0 112.49 8.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 47.1 Cg_exo -66.63 -39.46 15.76 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.617 1.545 . . . . 0.0 114.391 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 56.0 m -67.62 -36.92 81.74 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 m -85.05 78.63 9.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.76 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -143.09 150.83 40.03 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.414 1.102 . . . . 0.0 110.187 -171.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.592 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 32.5 m-85 -125.95 154.94 42.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.35 -175.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.31 -138.69 4.55 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.285 -172.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.92 85.5 6.21 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 122.018 0.913 . . . . 0.0 109.098 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.592 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 82.7 mtp -84.88 -108.66 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -177.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -108.23 66.8 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 171.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 90.2 m -129.06 -175.65 3.62 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.19 0.995 . . . . 0.0 111.015 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -77.96 170.59 16.34 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.676 0.751 . . . . 0.0 110.669 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -53.53 -55.53 24.75 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.8 mtm105 -94.52 22.93 5.66 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.577 177.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -116.96 159.6 22.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.535 1.159 . . . . 0.0 109.353 178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -133.85 173.05 11.96 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.776 176.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB3' ' HB2' ' A' ' 25' ' ' PHE . 5.8 t -99.69 155.02 17.84 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.912 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -148.56 150.93 34.2 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.541 -0.864 . . . . 0.0 109.536 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -133.92 117.15 16.43 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.916 0.865 . . . . 0.0 110.089 -179.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -99.32 -72.58 0.66 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 176.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.64 78.15 0.3 Allowed Glycine 0 N--CA 1.468 0.785 0 N-CA-C 108.637 -1.785 . . . . 0.0 108.637 171.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 61.3 m 60.73 61.26 1.72 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.991 0.901 . . . . 0.0 110.79 -170.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -176.49 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 81.1 t80 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -82.87 -86.71 0.1 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.355 -0.841 . . . . 0.0 111.011 -170.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -76.15 -38.75 56.35 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.431 -0.793 . . . . 0.0 112.14 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.4 t -55.41 -37.53 67.76 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -72.18 -39.09 68.93 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.723 -0.611 . . . . 0.0 112.279 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -66.27 -41.35 90.0 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.827 -0.546 . . . . 0.0 112.398 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -66.01 -38.55 88.74 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.423 -0.798 . . . . 0.0 111.656 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.16 83.84 1.7 Allowed Glycine 0 N--CA 1.467 0.734 0 C-N-CA 120.267 -0.968 . . . . 0.0 111.458 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.78 148.31 10.02 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.307 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -83.46 154.82 23.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.596 0.712 . . . . 0.0 109.183 175.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 37.2 m -78.76 125.3 29.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.724 -0.79 . . . . 0.0 110.133 177.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -128.98 148.34 68.56 Favored Pre-proline 0 N--CA 1.468 0.475 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.633 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -56.95 166.9 3.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.934 1.756 . . . . 0.0 113.55 173.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -61.67 -37.83 85.53 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.54 -20.13 66.21 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -176.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -75.69 124.46 27.28 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.381 -0.824 . . . . 0.0 111.106 -175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.3 mt -74.28 137.09 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.091 0.948 . . . . 0.0 109.638 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 33.5 t -88.56 123.95 33.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.0 tp -134.11 125.24 17.91 Favored Pre-proline 0 CA--C 1.538 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -70.46 167.14 73.97 Favored 'Cis proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.048 -1.647 . . . . 0.0 114.165 7.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -66.97 -30.13 39.84 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.702 1.601 . . . . 0.0 114.711 -171.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.6 m -69.35 -43.19 74.12 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -172.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -90.02 73.28 7.35 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.51 -0.744 . . . . 0.0 111.652 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -123.19 132.66 54.14 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -117.85 148.56 42.0 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.37 0.605 . . . . 0.0 109.45 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.64 -124.74 2.04 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.882 -175.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.97 113.12 16.83 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.3 mmm -117.91 -93.18 0.52 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -171.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -138.07 59.95 1.64 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 75.1 m -123.28 -88.93 0.61 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -179.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -159.54 -168.85 2.4 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 62.0 t-105 -61.95 -50.64 71.31 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -173.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -102.13 21.28 15.15 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -118.35 164.39 15.29 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 122.601 1.191 . . . . 0.0 110.304 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -132.81 178.8 6.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.702 -178.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 12.8 m -118.27 145.22 45.21 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.917 0.865 . . . . 0.0 109.752 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.421 ' SG ' ' HD2' ' A' ' 39' ' ' LYS . 42.8 t -141.89 141.36 33.02 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.904 0.859 . . . . 0.0 109.784 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -92.99 89.16 6.41 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.277 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.421 ' HD2' ' SG ' ' A' ' 37' ' ' CYS . 14.4 ptmm? -135.69 -56.07 0.78 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.114 -178.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.74 -121.51 0.99 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.648 -1.263 . . . . 0.0 111.265 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -91.9 -48.62 6.67 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.387 -175.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -178.37 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 58.0 t80 . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 120.612 0.244 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -74.08 -57.0 4.26 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.193 -0.942 . . . . 0.0 111.361 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -76.93 -49.02 16.52 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.734 -0.786 . . . . 0.0 112.533 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.9 t -75.13 -31.02 60.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.344 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -68.88 -29.1 67.32 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.366 -0.834 . . . . 0.0 111.958 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -61.61 -39.86 92.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.494 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -75.13 -45.53 40.4 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.38 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.89 91.14 1.37 Allowed Glycine 0 N--CA 1.466 0.639 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.34 -176.24 39.14 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 118.845 -1.645 . . . . 0.0 112.91 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -138.91 145.29 39.68 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.7 m -90.86 143.8 26.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.642 1.21 . . . . 0.0 112.232 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -141.47 158.82 62.63 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.374 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.54 164.13 3.25 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.821 1.681 . . . . 0.0 113.493 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.17 -22.57 62.95 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.57 -24.45 39.19 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -176.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -74.43 142.92 44.92 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.98 0.895 . . . . 0.0 110.821 -176.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.8 mt -82.0 131.81 32.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.92 0.867 . . . . 0.0 109.676 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 95.8 m -98.33 102.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 169.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.404 HD12 ' HD3' ' A' ' 21' ' ' PRO . 18.5 tp -110.38 133.61 21.05 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 163.31 86.11 Favored 'Cis proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.383 5.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HD3' HD12 ' A' ' 19' ' ' LEU . 50.8 Cg_endo -69.92 -24.33 29.07 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.645 1.563 . . . . 0.0 113.599 -171.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p -87.62 49.44 1.81 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 122.056 0.932 . . . . 0.0 110.49 174.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 t -150.91 51.4 0.86 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' SG ' ' A' ' 37' ' ' CYS . 32.3 t70 -140.64 129.19 22.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.652 0.739 . . . . 0.0 109.291 -171.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -116.21 162.12 17.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.9 -145.56 5.9 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 119.231 -1.461 . . . . 0.0 111.546 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -78.81 101.72 7.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.268 1.032 . . . . 0.0 108.952 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.409 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 90.9 mtp -96.92 -118.81 0.12 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -96.81 62.77 1.93 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.0 0.905 . . . . 0.0 108.719 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 50.3 m -146.92 -160.97 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.519 0.676 . . . . 0.0 110.301 -174.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -71.21 157.17 38.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.185 0.993 . . . . 0.0 110.913 -174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -56.79 -50.22 72.99 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.68 12.1 31.02 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.858 -177.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -108.82 172.0 7.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.378 -0.826 . . . . 0.0 108.868 175.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -139.59 173.82 11.14 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.626 -0.829 . . . . 0.0 110.591 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.409 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.8 t -109.44 153.08 24.53 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.557 -177.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 89.2 m -139.43 157.79 45.25 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.342 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -80.69 80.31 7.17 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.997 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -127.5 166.41 18.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.329 1.061 . . . . 0.0 109.967 177.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -98.82 -62.77 0.85 Allowed Glycine 0 N--CA 1.466 0.692 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 169.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.6 p -147.86 72.04 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.784 -0.766 . . . . 0.0 109.85 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.479 -1.343 . . . . 0.0 111.094 178.116 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.0 p90 . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 121.817 0.818 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -156.07 -58.15 0.09 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 118.983 -1.087 . . . . 0.0 111.757 -172.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -74.11 -60.59 2.19 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.636 -0.826 . . . . 0.0 112.372 -170.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.6 t -78.37 -36.3 46.21 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.994 -1.066 . . . . 0.0 112.318 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -65.82 -37.37 86.07 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.061 -0.656 . . . . 0.0 112.404 -174.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -78.96 -29.82 44.17 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.065 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -79.36 -59.68 2.66 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.258 -0.902 . . . . 0.0 110.254 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.09 90.6 0.15 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 119.724 -1.227 . . . . 0.0 111.245 176.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.69 -177.13 40.5 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 119.017 -1.563 . . . . 0.0 112.68 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -138.17 150.35 46.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m -82.1 136.95 35.11 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 122.117 0.96 . . . . 0.0 112.354 -176.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -139.04 147.34 53.31 Favored Pre-proline 0 N--CA 1.467 0.398 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.9 148.21 48.01 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 121.729 1.619 . . . . 0.0 112.338 173.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -70.48 -45.05 66.45 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.553 -174.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.19 -33.58 74.81 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.31 147.89 29.66 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.974 0.893 . . . . 0.0 109.835 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -86.78 133.79 29.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.221 1.01 . . . . 0.0 111.303 -169.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.9 m -77.61 133.68 38.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.353 170.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.26 113.95 13.5 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -176.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.89 159.09 80.23 Favored 'Cis proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.184 -1.59 . . . . 0.0 112.627 10.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -93.9 48.52 0.31 Allowed 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 121.58 1.52 . . . . 0.0 111.123 -173.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -74.62 -41.35 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.172 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -149.3 120.13 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.625 -0.83 . . . . 0.0 109.864 -173.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -114.85 104.51 12.02 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.89 0.852 . . . . 0.0 109.536 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.7 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 63.6 m-85 -79.2 162.94 25.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.065 0.936 . . . . 0.0 110.354 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.2 -126.99 5.27 Favored Glycine 0 N--CA 1.465 0.602 0 C-N-CA 119.64 -1.267 . . . . 0.0 111.741 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -82.12 96.82 7.91 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.004 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.7 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 71.2 mtp -108.36 -116.01 0.28 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -177.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.437 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 60.8 m-20 -91.11 53.51 2.37 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.129 169.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.5 m -135.55 171.98 13.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.998 0.904 . . . . 0.0 110.78 -173.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -64.56 166.14 9.0 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.654 0.74 . . . . 0.0 110.541 179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.5 t-105 -55.17 -51.96 64.85 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -174.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -96.03 24.29 5.69 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.463 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -111.23 -174.37 2.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 122.115 0.96 . . . . 0.0 108.811 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -150.2 166.99 28.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.24 -172.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.553 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 1.8 t -111.47 140.53 45.99 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.194 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.5 m -121.11 152.46 38.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.16 0.981 . . . . 0.0 110.588 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -148.86 131.5 15.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.31 -0.859 . . . . 0.0 108.831 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -80.05 172.82 13.27 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.589 174.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 118.15 -169.08 13.23 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 119.751 -1.214 . . . . 0.0 112.441 173.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 88.5 p -91.14 53.33 2.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.704 -0.748 . . . . 0.0 111.452 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.112 0 C-N-CA 119.996 -1.097 . . . . 0.0 110.785 -179.467 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 89.8 t80 . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 120.382 0.134 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.0 tptm -99.41 -62.1 1.28 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.476 -0.89 . . . . 0.0 111.934 -170.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.56 -59.97 2.56 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.252 -170.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.447 ' H ' ' HB2' ' A' ' 29' ' ' ASP . 14.1 t -77.37 -30.75 53.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.968 -172.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.41 -34.87 78.67 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.594 -0.691 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -70.25 -41.04 74.03 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.762 177.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -74.79 -57.86 3.65 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.992 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.53 84.67 0.07 OUTLIER Glycine 0 N--CA 1.465 0.595 0 C-N-CA 119.837 -1.173 . . . . 0.0 110.466 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.67 169.21 39.06 Favored Glycine 0 CA--C 1.525 0.694 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.542 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -128.56 128.11 43.63 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 36' ' ' CYS . 48.7 t -80.81 136.15 36.07 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.321 1.058 . . . . 0.0 111.796 -175.191 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -138.51 158.41 70.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.81 -1.087 . . . . 0.0 108.202 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HA ' ' CG ' ' A' ' 34' ' ' TRP . 54.5 Cg_exo -61.72 178.46 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 121.442 1.428 . . . . 0.0 114.123 -179.177 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -61.8 -44.94 95.87 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.431 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -63.55 -26.5 68.73 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -76.05 133.01 40.46 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.507 -173.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.1 mt -81.3 131.12 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.913 0.864 . . . . 0.0 110.051 -175.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -86.42 134.54 33.69 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -133.7 113.76 12.99 Favored Pre-proline 0 C--N 1.325 -0.491 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -177.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.19 160.69 96.04 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 123.397 -1.501 . . . . 0.0 112.239 5.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.37 -26.66 10.14 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 121.837 1.692 . . . . 0.0 113.268 -174.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 84.6 p -71.23 -24.92 62.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.436 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.7 m -91.99 71.49 5.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.825 0.821 . . . . 0.0 109.851 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -142.81 119.57 11.18 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.52 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 71.6 m-85 -83.81 176.32 9.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.796 177.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.39 -133.4 5.82 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 119.422 -1.371 . . . . 0.0 110.718 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -76.4 117.34 17.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.416 -0.913 . . . . 0.0 108.877 176.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.52 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 82.9 mtp -122.44 -106.3 0.36 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.625 -175.055 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.447 ' HB2' ' H ' ' A' ' 4' ' ' CYS . 15.5 t70 -95.4 50.67 1.26 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.545 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 p -157.47 -89.2 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.323 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -159.64 -173.39 4.11 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.643 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 18.3 t-105 -54.94 -62.46 1.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -83.71 1.55 42.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.484 -0.886 . . . . 0.0 112.927 -170.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.401 ' CG ' ' HA ' ' A' ' 13' ' ' PRO . 34.5 m0 -97.11 150.05 21.28 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.231 -0.918 . . . . 0.0 109.157 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.38 159.46 24.16 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.977 -174.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.428 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 8.8 t -111.24 116.2 30.63 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.257 175.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.28 126.68 33.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.851 0.834 . . . . 0.0 110.209 -175.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.05 121.95 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.882 0.849 . . . . 0.0 109.028 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -154.86 -50.68 0.09 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.075 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.89 -94.11 0.15 Allowed Glycine 0 N--CA 1.465 0.57 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -178.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.5 p -132.34 83.54 2.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.961 0.886 . . . . 0.0 110.131 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 C-N-CA 119.625 -1.274 . . . . 0.0 110.757 177.678 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 57.9 t80 . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.675 0.274 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -82.33 -68.84 0.67 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.441 -0.787 . . . . 0.0 109.827 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -77.35 -43.66 32.16 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.073 -177.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.47 ' SG ' ' SD ' ' A' ' 28' ' ' MET . 14.1 t -72.13 -29.1 63.73 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 119.237 -0.985 . . . . 0.0 113.553 -173.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -69.45 -31.67 70.13 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.329 -0.948 . . . . 0.0 111.404 176.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -66.15 -38.36 87.91 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.341 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -74.78 -49.18 21.77 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.271 175.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.89 80.31 0.46 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.69 169.58 42.07 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 119.023 -1.56 . . . . 0.0 112.757 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -118.99 150.22 40.31 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.6 m -80.46 137.42 36.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.198 0.999 . . . . 0.0 111.329 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -133.75 137.67 29.19 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.54 165.96 8.71 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 C-N-CA 121.548 1.499 . . . . 0.0 112.344 175.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -77.77 86.07 4.05 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.98 0.895 . . . . 0.0 109.602 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 -27.74 0.24 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.263 -176.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -127.54 169.66 13.46 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.993 1.378 . . . . 0.0 112.533 -171.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.0 mt -77.95 137.17 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.3 t -86.54 117.32 25.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -137.13 114.27 9.83 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -169.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -70.23 164.62 80.11 Favored 'Cis proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.967 -1.68 . . . . 0.0 113.674 8.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -85.12 -24.26 2.14 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.588 1.526 . . . . 0.0 113.512 -169.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 85.9 p -66.59 -26.86 67.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.328 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -94.61 47.4 1.17 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.001 -0.68 . . . . 0.0 111.557 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -108.07 102.99 12.11 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.469 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 89.8 m-85 -79.61 161.03 26.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.3 -131.54 5.15 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 119.055 -1.545 . . . . 0.0 111.316 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -82.45 99.38 9.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 70.6 mtp -93.04 -112.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.131 -173.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.52 33.39 4.55 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.137 -0.977 . . . . 0.0 111.921 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 58.7 m -111.35 -83.24 0.58 Allowed 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.292 -178.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.7 ptp180 -158.38 -175.37 5.29 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 118.532 -1.267 . . . . 0.0 111.299 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -63.35 -48.7 76.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.947 -1.024 . . . . 0.0 113.016 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -97.44 23.68 7.37 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.435 -0.906 . . . . 0.0 113.113 -175.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -117.56 152.31 35.37 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.061 -1.024 . . . . 0.0 109.587 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -110.7 166.94 10.61 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.511 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 17.0 t -120.64 127.84 52.45 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 169.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.446 ' SG ' ' HG3' ' A' ' 39' ' ' LYS . 47.2 t -130.05 154.01 47.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.573 0.701 . . . . 0.0 109.617 -173.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -104.55 74.88 1.19 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.114 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.446 ' HG3' ' SG ' ' A' ' 37' ' ' CYS . 1.9 pptp? -160.46 170.31 21.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.027 0.918 . . . . 0.0 110.733 176.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -109.63 -83.19 1.43 Allowed Glycine 0 N--CA 1.467 0.724 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.017 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.1 m -93.43 86.47 5.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.875 0.845 . . . . 0.0 110.055 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 177.182 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.7 t80 . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 120.578 0.228 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.89 -38.34 64.41 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.429 -0.908 . . . . 0.0 113.298 -170.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.08 -47.73 17.65 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.17 -0.956 . . . . 0.0 111.505 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.61 -36.8 70.91 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -173.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -76.71 -42.98 39.35 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.359 -0.838 . . . . 0.0 111.621 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -62.98 -43.45 98.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.048 -0.661 . . . . 0.0 112.445 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -68.7 -33.63 74.29 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.761 -0.776 . . . . 0.0 112.322 -178.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.62 92.89 1.22 Allowed Glycine 0 N--CA 1.465 0.599 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.82 170.84 31.28 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 119.233 -1.461 . . . . 0.0 111.662 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.26 144.01 38.21 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -79.7 132.98 36.34 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.976 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -140.13 157.08 69.78 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -51.36 142.61 37.14 Favored 'Trans proline' 0 CA--C 1.53 0.304 0 C-N-CA 121.507 1.472 . . . . 0.0 110.547 169.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.83 -14.35 61.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -92.76 -20.5 20.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -90.25 -106.49 0.09 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.112 -169.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.8 mt -115.81 132.51 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 122.758 1.266 . . . . 0.0 111.309 -173.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 t -132.99 123.59 26.16 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.265 -2.494 . . . . 0.0 104.265 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -118.35 117.13 34.96 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -76.52 165.24 85.73 Favored 'Cis proline' 0 CA--C 1.534 0.518 0 C-N-CA 123.131 -1.612 . . . . 0.0 111.815 6.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -49.36 -65.21 0.17 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.31 2.007 . . . . 0.0 116.058 -168.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.7 m -97.75 65.23 1.82 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.063 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.2 m -154.17 108.83 3.06 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.396 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -160.76 149.22 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.373 1.082 . . . . 0.0 111.798 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 99.0 m-85 -84.41 164.62 18.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.49 -140.98 2.21 Favored Glycine 0 N--CA 1.466 0.663 0 C-N-CA 119.552 -1.308 . . . . 0.0 111.806 -172.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -80.59 100.0 8.4 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 122.736 1.255 . . . . 0.0 108.357 176.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 93.7 mtp -90.2 -81.24 0.3 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.633 -172.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -148.06 57.84 1.09 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 119.548 -0.861 . . . . 0.0 110.713 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.3 m -135.13 -102.15 0.22 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.852 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -135.81 166.78 22.49 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.456 -0.777 . . . . 0.0 109.331 -172.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -57.51 -60.19 4.03 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -85.77 14.35 6.01 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.704 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.0 m0 -111.7 132.19 54.79 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.128 -0.983 . . . . 0.0 108.685 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -115.18 158.74 21.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.894 0.854 . . . . 0.0 110.431 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 44.7 t -91.83 115.21 27.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -78.77 148.3 33.03 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.804 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -96.08 151.28 19.61 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.383 0.611 . . . . 0.0 110.973 -171.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.25 -49.98 6.07 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.69 176.446 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.72 -69.37 0.2 Allowed Glycine 0 N--CA 1.466 0.696 0 C-N-CA 119.501 -1.333 . . . . 0.0 111.725 -177.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 90.4 p -81.67 80.85 7.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.99 0.9 . . . . 0.0 110.752 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.173 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 -178.251 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.406 ' O ' ' HB3' ' A' ' 5' ' ' HIS . 74.8 t80 . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 120.668 0.27 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 tptt -85.95 -37.38 19.1 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 119.034 -1.067 . . . . 0.0 111.985 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.6 -61.61 1.94 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.814 -0.754 . . . . 0.0 112.412 -172.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 72.4 m -78.59 -33.94 47.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.189 -1.004 . . . . 0.0 113.391 -174.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 1' ' ' TYR . 48.4 t-80 -72.31 -41.42 66.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.192 -0.943 . . . . 0.0 112.867 -173.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -65.55 -34.62 78.68 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.551 178.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -74.44 -47.86 31.06 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.455 173.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.11 69.17 0.18 Allowed Glycine 0 N--CA 1.465 0.593 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.991 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.47 -178.06 33.13 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 119.342 -1.408 . . . . 0.0 111.853 -177.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -155.51 158.93 39.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.9 m -78.81 120.27 23.2 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.338 -176.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 92.0 m-85 -120.02 152.3 54.0 Favored Pre-proline 0 N--CA 1.469 0.509 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 46.6 Cg_exo -69.52 153.29 70.21 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 121.37 1.38 . . . . 0.0 113.03 -175.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -68.89 -25.35 64.56 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.67 -26.46 66.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -91.54 137.26 32.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.748 0.785 . . . . 0.0 109.598 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.7 mt -85.93 124.78 40.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.778 -174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.1 t -93.77 138.46 31.93 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -125.46 122.87 24.99 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -171.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -81.0 165.99 75.23 Favored 'Cis proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.398 -1.501 . . . . 0.0 112.57 7.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.72 -12.39 15.03 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 121.723 1.615 . . . . 0.0 113.548 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.1 t -102.8 45.27 0.97 Allowed 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.452 -0.78 . . . . 0.0 111.512 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.0 p -160.55 63.73 0.32 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.862 0.839 . . . . 0.0 109.52 177.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -153.43 135.57 14.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.157 0.98 . . . . 0.0 109.114 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.717 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 82.7 m-85 -92.21 168.24 11.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.786 0.803 . . . . 0.0 109.4 179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.12 -116.05 2.68 Favored Glycine 0 N--CA 1.466 0.649 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.025 -174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -86.22 78.83 9.27 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.286 -0.965 . . . . 0.0 109.56 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.717 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.2 mtp -78.72 -85.28 0.08 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.8 p30 -120.94 40.52 3.53 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.045 0.926 . . . . 0.0 109.141 169.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 70.9 m -111.91 178.46 4.31 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.861 0.839 . . . . 0.0 110.557 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -95.35 -168.48 1.8 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.104 0.954 . . . . 0.0 111.24 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -55.69 -60.3 3.64 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -80.68 -6.01 57.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -111.38 163.54 13.89 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.853 -1.155 . . . . 0.0 110.509 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -147.64 166.67 26.71 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 57.8 m -94.0 120.25 33.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.059 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 t -97.02 142.76 28.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.955 174.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -113.38 103.96 11.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.546 0.689 . . . . 0.0 109.208 -179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -26.35 29.57 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.67 75.5 0.05 OUTLIER Glycine 0 CA--C 1.525 0.683 0 C-N-CA 119.425 -1.369 . . . . 0.0 111.487 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.1 t -163.77 72.96 0.28 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.182 0 C-N-CA 119.704 -1.236 . . . . 0.0 110.286 -174.614 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 52.0 p90 . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -95.01 -66.41 0.91 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -172.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -77.77 -51.47 10.48 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 119.848 -0.741 . . . . 0.0 112.016 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.7 t -58.87 -40.52 84.6 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -176.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -77.93 -39.04 44.08 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 119.503 -0.879 . . . . 0.0 112.444 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -72.56 -35.07 67.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.369 -0.832 . . . . 0.0 112.41 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -65.04 -42.96 93.84 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.51 -0.744 . . . . 0.0 111.499 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.84 76.53 0.15 Allowed Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.884 -1.151 . . . . 0.0 110.527 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -179.73 -179.16 48.76 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 118.897 -1.62 . . . . 0.0 112.125 -177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -136.43 144.23 44.33 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.7 t -79.72 132.86 36.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.27 1.033 . . . . 0.0 111.836 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.25 153.19 70.9 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -56.88 168.87 2.15 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 121.647 1.565 . . . . 0.0 112.905 175.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -80.28 -9.31 59.73 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.25 47.27 2.42 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.2 1.0 . . . . 0.0 111.915 -172.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -145.14 175.04 10.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.94 0.876 . . . . 0.0 110.255 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -90.74 122.85 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.734 0.778 . . . . 0.0 110.337 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.5 p -123.47 152.85 41.27 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.04 116.87 51.06 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -84.67 159.87 67.18 Favored 'Cis proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.297 -1.543 . . . . 0.0 112.05 9.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -82.73 -57.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 121.361 1.374 . . . . 0.0 112.781 -171.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m -92.98 58.69 3.01 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.374 -173.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 t -164.2 88.19 0.51 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.77 159.38 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.61 1.195 . . . . 0.0 111.875 -173.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.519 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 80.8 m-85 -97.71 179.22 4.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.497 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.07 -130.46 5.79 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 119.526 -1.321 . . . . 0.0 110.699 -176.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -81.93 109.08 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 118.954 -1.098 . . . . 0.0 108.787 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.595 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.3 mtp -107.45 -121.1 0.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.24 66.05 1.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.6 t -146.55 -142.25 0.13 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -83.41 160.6 21.56 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 120.943 -1.098 . . . . 0.0 109.997 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.3 t-105 -55.43 -38.1 68.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -110.45 14.15 22.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -104.89 151.85 23.35 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.036 -1.04 . . . . 0.0 109.867 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -110.3 165.81 11.47 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.067 0.937 . . . . 0.0 110.992 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.595 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 50.3 t -114.66 113.14 23.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -177.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 93.1 m -78.34 144.7 35.8 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.423 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -90.54 120.94 32.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.732 0.777 . . . . 0.0 110.337 -173.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -130.81 -71.51 0.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.91 0.862 . . . . 0.0 109.715 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 135.23 63.04 0.06 OUTLIER Glycine 0 CA--C 1.526 0.72 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -171.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.2 t 66.23 88.71 0.11 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.834 0.826 . . . . 0.0 111.362 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.25 0 C-N-CA 119.392 -1.385 . . . . 0.0 110.756 179.741 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 69.4 t80 . . . . . 0 N--CA 1.475 0.79 0 CA-C-O 120.737 0.303 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -90.47 -66.01 0.96 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.456 -177.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -78.24 -50.74 11.31 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 119.696 -0.801 . . . . 0.0 112.411 -174.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.696 ' SG ' ' CB ' ' A' ' 28' ' ' MET . 86.5 m -62.96 -30.48 71.61 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.644 -0.822 . . . . 0.0 113.183 -177.604 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -72.13 -31.15 65.73 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.791 -0.764 . . . . 0.0 112.342 -179.2 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -71.55 -42.57 67.71 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.521 -0.737 . . . . 0.0 111.648 176.85 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.16 -44.9 59.31 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.447 -179.521 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.69 70.89 0.3 Allowed Glycine 0 N--CA 1.465 0.6 0 C-N-CA 120.031 -1.081 . . . . 0.0 110.406 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.32 159.32 30.35 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 119.627 -1.273 . . . . 0.0 110.534 -179.214 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -112.4 145.53 39.97 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 9.0 m -79.33 134.2 36.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.206 1.003 . . . . 0.0 110.873 179.335 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -142.5 154.57 63.58 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 176.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.07 161.51 2.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 121.648 1.565 . . . . 0.0 112.79 172.101 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -62.19 -29.48 70.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -178.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.58 -25.26 63.89 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.551 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -87.2 135.66 33.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.188 0.994 . . . . 0.0 110.728 -171.033 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -128.55 130.84 69.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.911 -176.894 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 29.2 p -91.91 101.85 14.42 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 170.414 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.42 HD12 ' HD3' ' A' ' 21' ' ' PRO . 14.7 tp -70.7 138.28 85.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.312 -172.361 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -85.04 168.08 52.62 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 123.647 -1.397 . . . . 0.0 112.618 8.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD3' HD12 ' A' ' 19' ' ' LEU . 56.7 Cg_endo -93.19 52.27 0.41 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 121.333 1.355 . . . . 0.0 111.649 -169.734 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.7 t -92.37 -59.4 2.09 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.981 -174.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -100.19 82.31 2.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.01 0.909 . . . . 0.0 109.386 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -109.82 103.79 12.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' HB2' ' A' ' 35' ' ' LYS . 52.5 m-85 -82.04 158.25 23.86 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.842 -0.743 . . . . 0.0 109.713 -177.868 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.3 -137.37 5.76 Favored Glycine 0 N--CA 1.468 0.792 0 C-N-CA 119.779 -1.201 . . . . 0.0 111.695 -174.393 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -76.01 104.89 6.76 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.355 1.074 . . . . 0.0 108.959 176.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.696 ' CB ' ' SG ' ' A' ' 4' ' ' CYS . 66.7 mmm -95.58 -76.36 0.5 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.844 -172.799 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -153.41 58.74 0.76 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.9 0.857 . . . . 0.0 110.1 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.5 m -141.45 -71.23 0.35 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.7 -175.556 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -151.26 165.55 33.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.866 0.841 . . . . 0.0 109.544 -177.425 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -60.48 -48.56 81.22 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -177.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -100.5 13.62 34.0 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.736 -0.785 . . . . 0.0 112.991 -177.574 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -108.27 165.81 11.22 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -146.73 174.9 11.04 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -175.558 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 99.1 m -110.29 123.74 50.37 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.612 176.707 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 45.1 t -104.96 149.67 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.117 0.961 . . . . 0.0 110.508 -177.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -149.15 130.45 14.65 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -176.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -74.98 -135.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.989 -0.685 . . . . 0.0 110.71 -175.033 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.67 -73.73 0.06 OUTLIER Glycine 0 CA--C 1.525 0.656 0 C-N-CA 119.498 -1.334 . . . . 0.0 111.274 -176.142 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -82.47 -62.29 1.65 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.158 -176.862 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.483 -1.176 . . . . 0.0 110.818 -178.76 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 64.2 t80 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 121.267 0.556 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -174.27 -69.76 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.982 170.044 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -78.99 -50.56 10.91 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.838 -172.838 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.8 t -70.94 -32.88 69.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 119.087 -1.045 . . . . 0.0 112.629 -172.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -67.52 -36.31 80.78 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.079 178.691 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.55 -42.7 95.54 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.573 179.012 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -72.46 -45.63 58.63 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.325 177.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 124.11 77.79 0.35 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.594 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.58 174.31 38.94 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 119.262 -1.447 . . . . 0.0 111.91 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -141.25 154.56 45.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.165 0.983 . . . . 0.0 109.655 -178.601 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.6 t -79.09 123.89 27.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.936 0.874 . . . . 0.0 111.39 -175.622 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -136.45 159.27 71.26 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.145 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.66 149.02 51.42 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.788 1.659 . . . . 0.0 112.678 177.116 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -73.08 -52.04 15.8 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.927 -176.755 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.84 -26.28 68.26 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -176.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -77.06 147.03 36.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.972 0.891 . . . . 0.0 110.722 -178.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.3 mt -71.16 135.7 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 122.214 1.007 . . . . 0.0 110.938 -177.049 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.7 t -95.0 116.3 28.52 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 168.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -124.43 117.42 26.56 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -172.512 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.19 159.29 93.04 Favored 'Cis proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.298 -1.542 . . . . 0.0 111.949 6.086 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -94.58 55.63 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 121.532 1.488 . . . . 0.0 111.56 -169.619 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.3 p -67.94 -64.01 0.95 Allowed 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.767 -0.773 . . . . 0.0 112.305 -173.116 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.1 m -144.18 112.72 6.55 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 119.359 -0.937 . . . . 0.0 110.465 -179.364 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -98.35 118.36 34.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.08 0.943 . . . . 0.0 109.347 175.32 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.67 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 78.0 m-85 -92.3 165.85 12.89 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.606 178.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -77.91 -134.48 0.78 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 119.599 -1.286 . . . . 0.0 111.832 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -84.47 90.38 7.6 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.507 178.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.67 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 84.2 mtp -95.34 -115.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.459 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -91.36 75.52 6.03 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 171.348 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.7 t -148.2 168.21 23.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.074 -1.051 . . . . 0.0 110.986 -170.013 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' H ' ' A' ' 32' ' ' TRP . 70.0 ttt180 -73.6 178.07 4.96 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.537 0.684 . . . . 0.0 110.627 -175.903 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.471 ' H ' ' HG2' ' A' ' 31' ' ' ARG . 59.1 t-105 -55.79 -60.75 3.01 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.492 -0.755 . . . . 0.0 112.826 -172.14 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -95.44 24.03 5.48 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.6 -0.84 . . . . 0.0 112.432 178.737 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.3 m0 -112.28 163.46 14.36 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.138 -0.976 . . . . 0.0 110.024 -177.414 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -125.64 168.28 13.94 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.987 -178.381 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 t -106.79 133.09 51.98 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.326 176.471 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 49.7 t -120.49 145.3 47.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 122.178 0.99 . . . . 0.0 112.083 -173.606 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -96.09 152.76 18.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.999 173.581 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.464 ' H ' ' CD ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -85.64 -175.99 5.87 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.48 176.445 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.36 -113.83 3.86 Favored Glycine 0 N--CA 1.466 0.673 0 C-N-CA 119.579 -1.296 . . . . 0.0 111.956 -172.509 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -91.22 79.15 5.73 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.087 0.946 . . . . 0.0 110.119 -175.793 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.913 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 31.2 p90 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 122.1 0.952 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -135.16 -70.16 0.49 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.777 -178.675 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -72.06 -50.57 27.24 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.758 -177.25 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.5 t -77.18 -29.45 54.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.652 -0.819 . . . . 0.0 112.276 -176.48 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -68.16 -36.07 79.06 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.803 -0.759 . . . . 0.0 111.524 175.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -66.22 -42.66 88.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.478 177.06 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.97 -49.58 50.27 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.011 174.734 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.82 85.24 0.58 Allowed Glycine 0 N--CA 1.465 0.629 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.3 -176.52 39.87 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.541 -1.314 . . . . 0.0 111.314 -178.806 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -143.82 138.0 28.38 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.66 -0.816 . . . . 0.0 109.377 -178.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.5 m -80.14 135.01 36.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.451 1.12 . . . . 0.0 111.149 179.146 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -129.22 145.57 57.26 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.056 175.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -56.37 166.16 3.69 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.686 1.591 . . . . 0.0 113.208 177.389 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -59.41 -45.46 91.48 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.675 178.438 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.84 -27.15 69.13 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -175.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -86.97 134.49 33.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.132 0.967 . . . . 0.0 110.369 -172.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.4 mt -112.58 124.97 69.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.001 -171.659 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.4 p -94.33 137.06 33.93 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 168.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.83 120.58 55.23 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.584 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -86.02 159.01 57.77 Favored 'Cis proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.236 -1.568 . . . . 0.0 112.219 9.87 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.81 -27.04 4.18 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 121.743 1.629 . . . . 0.0 113.198 -173.275 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 95.7 p -85.28 59.57 5.71 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.478 -0.764 . . . . 0.0 110.763 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.7 m -162.44 80.73 0.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.399 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -158.59 147.33 18.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.124 0.964 . . . . 0.0 110.595 -175.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.49 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 84.4 m-85 -82.05 160.23 23.27 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.481 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -121.4 0.6 Allowed Glycine 0 N--CA 1.465 0.606 0 C-N-CA 119.244 -1.455 . . . . 0.0 110.754 -175.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -88.29 95.89 10.36 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.445 -0.902 . . . . 0.0 108.63 177.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.49 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.9 mtp -86.98 -108.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.53 50.61 0.8 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.96 0.886 . . . . 0.0 110.109 174.964 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.2 m -141.41 177.97 7.75 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -177.354 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -74.02 -178.85 3.48 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.272 1.034 . . . . 0.0 112.228 -171.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -57.17 -52.58 64.73 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -172.128 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -89.82 -3.26 58.22 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.566 -0.854 . . . . 0.0 113.104 -171.749 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -99.59 147.11 25.71 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.817 -1.177 . . . . 0.0 109.469 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -124.43 155.57 38.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -174.261 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.447 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 6.5 t -99.54 114.14 26.96 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.922 -1.111 . . . . 0.0 109.762 176.881 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.1 t -86.45 144.56 27.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.241 1.019 . . . . 0.0 111.171 -174.202 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -156.85 119.59 4.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.348 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -80.63 171.45 15.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.539 1.161 . . . . 0.0 112.333 -175.31 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -94.79 -64.68 1.0 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 169.661 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.8 t -154.58 96.15 1.86 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.893 -0.723 . . . . 0.0 109.181 177.117 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 C-N-CA 119.671 -1.252 . . . . 0.0 110.736 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 73.3 t80 . . . . . 0 N--CA 1.472 0.658 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -142.21 -137.68 0.11 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 119.704 -0.799 . . . . 0.0 109.247 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -75.12 -49.26 20.15 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.195 -0.94 . . . . 0.0 112.771 -170.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 83.7 m -62.46 -32.79 73.72 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.294 -0.878 . . . . 0.0 112.206 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -71.88 -29.86 64.8 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.163 -0.615 . . . . 0.0 112.375 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -66.11 -43.3 87.6 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.59 -0.694 . . . . 0.0 111.732 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -72.9 -36.33 67.27 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 119.499 -0.88 . . . . 0.0 111.579 176.623 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.42 57.35 0.29 Allowed Glycine 0 N--CA 1.467 0.761 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.509 175.299 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -158.02 -170.59 22.94 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 119.632 -1.27 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -142.41 161.0 39.16 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.123 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 88.1 m -79.82 144.1 33.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.089 0.947 . . . . 0.0 111.087 175.825 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -135.26 145.55 54.45 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.036 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.2 153.91 55.72 Favored 'Trans proline' 0 C--N 1.332 -0.29 0 C-N-CA 121.556 1.504 . . . . 0.0 112.284 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -84.13 79.99 9.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.243 1.02 . . . . 0.0 110.205 -176.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -154.23 -35.84 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.773 178.495 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -93.24 156.2 16.97 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.887 0.851 . . . . 0.0 109.69 177.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.9 mt -87.13 130.65 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.096 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.2 t -86.8 131.31 34.16 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.676 173.127 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -122.96 119.81 27.75 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -173.378 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.84 161.06 83.2 Favored 'Cis proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.423 -1.49 . . . . 0.0 111.951 6.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -80.07 -7.96 14.22 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 121.69 1.594 . . . . 0.0 113.499 -176.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -71.51 -42.82 67.51 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.443 -0.786 . . . . 0.0 111.794 -178.501 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -88.56 65.75 7.94 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 122.309 1.052 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -118.41 120.1 36.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.584 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.8 m-85 -102.6 153.09 20.44 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.746 -0.782 . . . . 0.0 109.473 -175.51 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.98 -118.86 2.15 Favored Glycine 0 N--CA 1.466 0.639 0 C-N-CA 119.391 -1.385 . . . . 0.0 111.419 -171.902 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -83.37 81.54 8.67 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.178 178.134 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.584 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 86.6 mtp -83.37 -71.52 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.083 -179.716 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.449 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 35.3 t70 -126.9 31.48 5.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.571 0.701 . . . . 0.0 109.813 178.216 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 95.0 m -150.66 178.4 9.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 122.185 0.993 . . . . 0.0 110.86 -171.936 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -77.8 -175.44 3.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 122.253 1.025 . . . . 0.0 112.162 -171.857 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.1 t-105 -63.36 -51.43 65.93 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.379 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.39 6.52 11.96 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.888 -175.46 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 14.2 m0 -121.31 156.72 31.96 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -142.96 161.72 37.38 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.144 -177.44 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 43.2 m -102.02 153.88 19.48 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 119.651 -0.819 . . . . 0.0 110.054 174.86 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -149.82 156.7 42.26 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.933 -179.951 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -143.44 163.0 34.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 173.905 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -62.84 -46.73 86.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.302 -0.874 . . . . 0.0 112.657 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 145.09 76.29 0.03 OUTLIER Glycine 0 N--CA 1.465 0.597 0 C-N-CA 119.683 -1.246 . . . . 0.0 110.852 178.725 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.2 m -153.77 65.14 0.73 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.679 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.104 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.43 178.479 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.6 p90 . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 122.304 1.05 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -107.97 -64.12 1.25 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.174 -178.433 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -77.94 -49.67 13.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 119.499 -0.881 . . . . 0.0 112.011 -177.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.94 -36.99 75.7 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.997 -179.301 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -74.29 -37.98 63.51 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.012 178.797 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -67.77 -38.01 82.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.946 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -64.88 -37.3 87.16 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.615 176.616 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.42 66.85 0.68 Allowed Glycine 0 N--CA 1.466 0.681 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -178.864 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.97 170.74 30.72 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 119.503 -1.332 . . . . 0.0 111.48 -176.921 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -126.94 152.01 47.71 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 176.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.8 m -80.71 135.5 36.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.167 0.984 . . . . 0.0 111.418 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.9 m-85 -139.11 143.87 38.52 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.178 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.77 163.23 2.05 Favored 'Trans proline' 0 C--N 1.331 -0.361 0 C-N-CA 121.657 1.571 . . . . 0.0 112.213 171.051 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -85.12 45.9 1.22 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.713 -174.401 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -145.41 -29.02 0.44 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -173.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -87.44 172.82 9.52 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.273 1.035 . . . . 0.0 111.961 -171.542 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.48 139.97 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 122.381 1.086 . . . . 0.0 110.284 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -116.12 142.65 46.53 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 168.586 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.417 ' C ' HD13 ' A' ' 19' ' ' LEU . 1.9 tm? -135.41 114.76 11.5 Favored Pre-proline 0 C--N 1.325 -0.49 0 C-N-CA 119.301 -0.96 . . . . 0.0 108.61 -174.094 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.97 158.75 96.24 Favored 'Cis proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.375 -1.511 . . . . 0.0 111.699 2.644 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.92 -27.79 0.87 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.163 1.242 . . . . 0.0 114.444 -168.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.5 m -94.7 59.26 2.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.15 -0.969 . . . . 0.0 111.434 -172.086 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.4 m -166.18 69.16 0.12 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 175.478 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -128.45 130.27 47.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 122.171 0.986 . . . . 0.0 110.538 -176.499 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 23.5 m-85 -86.56 170.06 12.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.22 178.426 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.03 -137.84 6.34 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 119.54 -1.314 . . . . 0.0 111.202 -178.037 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -76.22 115.3 15.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.335 177.858 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.1 mtp -119.42 -95.95 0.48 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.72 -0.792 . . . . 0.0 109.051 -175.695 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.519 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 2.9 m-20 -107.79 53.71 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.33 179.602 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.519 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 58.2 m -152.2 -163.63 1.78 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.94 -178.88 5.73 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 120.932 -1.105 . . . . 0.0 111.681 -171.674 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -58.23 -51.78 68.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -171.095 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -95.56 7.55 45.92 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.614 -0.834 . . . . 0.0 113.191 -170.156 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -104.05 162.09 13.44 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.117 -0.989 . . . . 0.0 109.781 -178.538 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -132.66 167.3 20.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.971 -174.683 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.578 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 43.2 t -114.28 106.9 14.89 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.653 -174.093 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 t -92.65 148.4 22.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.161 -1.016 . . . . 0.0 111.801 -174.714 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -129.92 158.79 38.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.893 0.854 . . . . 0.0 109.098 178.942 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -83.35 -172.28 4.05 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.117 0.961 . . . . 0.0 110.59 175.137 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.87 -76.4 1.13 Allowed Glycine 0 CA--C 1.524 0.609 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.446 176.188 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.8 p -92.91 70.72 4.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.03 0.919 . . . . 0.0 110.051 177.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.217 0 C-N-CA 119.711 -1.233 . . . . 0.0 110.118 179.936 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 61.8 t80 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -88.49 -71.65 0.58 Allowed 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.321 -0.862 . . . . 0.0 110.679 -178.814 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -77.46 -40.98 41.3 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.0 -176.172 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 10.5 t -73.1 -28.28 62.18 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.673 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -67.34 -28.78 68.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -174.6 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -54.88 -43.71 73.41 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 119.539 -0.865 . . . . 0.0 110.877 171.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -74.86 -48.99 22.09 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.723 173.17 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.28 84.5 1.18 Allowed Glycine 0 N--CA 1.467 0.729 0 C-N-CA 120.277 -0.963 . . . . 0.0 110.853 178.273 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.73 163.82 32.83 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 119.135 -1.507 . . . . 0.0 112.616 -176.68 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -120.83 154.93 35.11 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.651 0.739 . . . . 0.0 109.305 177.611 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.7 m -80.53 139.14 36.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.258 1.028 . . . . 0.0 111.574 -178.156 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -142.59 158.57 59.88 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 172.791 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.51 175.56 2.72 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 121.475 1.45 . . . . 0.0 113.395 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -93.39 75.46 4.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.614 0.721 . . . . 0.0 110.459 -176.229 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -169.29 -32.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.422 -177.436 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -85.47 172.18 11.2 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.55 1.167 . . . . 0.0 112.088 -173.221 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -87.74 134.01 28.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.816 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.65 105.25 17.36 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 171.529 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HA ' ' C ' ' A' ' 20' ' ' PRO . 23.9 tp -118.75 132.52 23.85 Favored Pre-proline 0 N--CA 1.469 0.48 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.173 -169.313 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.439 ' C ' ' HA ' ' A' ' 19' ' ' LEU . 62.2 Cg_exo -66.3 167.66 52.73 Favored 'Cis proline' 0 CA--C 1.532 0.411 0 CA-C-N 120.988 1.388 . . . . 0.0 114.0 4.427 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.81 75.16 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 121.444 1.429 . . . . 0.0 111.122 -169.076 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.2 p -140.05 -66.35 0.45 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.511 -177.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.9 m -99.39 81.95 2.6 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.713 0.768 . . . . 0.0 111.27 -172.474 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -106.61 118.08 35.74 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 172.505 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -95.7 153.74 17.57 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.7 -176.401 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.49 -122.77 1.97 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 119.667 -1.254 . . . . 0.0 111.363 -177.072 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -75.69 99.64 4.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 119.219 -0.992 . . . . 0.0 109.12 175.793 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 90.1 mmm -99.43 -120.39 0.15 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 176.201 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -103.62 40.77 1.37 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.089 -1.045 . . . . 0.0 110.714 170.218 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.9 m -93.97 -165.47 1.33 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 170.341 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -86.04 -171.21 3.46 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.752 -1.218 . . . . 0.0 109.918 176.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -59.47 -45.59 91.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -170.021 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -107.82 15.93 24.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -173.778 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -111.77 172.77 6.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.115 -0.991 . . . . 0.0 110.404 178.062 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -135.89 171.03 15.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.153 -0.619 . . . . 0.0 111.003 -174.919 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.3 t -113.71 143.42 44.64 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.787 -0.57 . . . . 0.0 109.94 177.164 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 19.5 t -125.26 143.2 51.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.851 0.834 . . . . 0.0 111.444 -175.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -139.25 148.53 43.17 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 173.252 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -79.66 -177.41 5.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.142 0.972 . . . . 0.0 111.712 178.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -110.47 -70.89 0.64 Allowed Glycine 0 N--CA 1.467 0.756 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 170.995 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.2 t -151.16 88.91 1.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 171.801 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 119.283 -1.437 . . . . 0.0 111.056 -177.249 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.7 tptp . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -76.72 -47.85 20.61 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.502 -0.749 . . . . 0.0 112.082 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -64.03 -40.27 95.96 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -172.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -66.95 -29.39 69.24 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -70.96 -48.78 51.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.763 -0.586 . . . . 0.0 112.549 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.88 -50.13 25.67 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.264 -0.898 . . . . 0.0 112.182 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.79 69.1 0.06 OUTLIER Glycine 0 N--CA 1.469 0.838 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.95 163.92 37.09 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.304 -176.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -137.49 144.03 42.02 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 92.9 m -78.77 133.57 37.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.151 0.977 . . . . 0.0 111.44 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -139.86 146.87 48.94 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.62 152.95 15.31 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.641 1.56 . . . . 0.0 112.527 171.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -23.61 60.98 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -89.45 -23.53 22.09 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -79.63 155.7 27.98 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.238 1.018 . . . . 0.0 111.583 -173.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.64 130.54 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 122.19 0.995 . . . . 0.0 112.049 -173.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.4 t -108.94 139.15 44.19 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 166.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.2 111.31 12.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.67 159.38 96.71 Favored 'Cis proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.957 7.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -86.04 -38.11 0.1 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 121.341 1.361 . . . . 0.0 114.904 -168.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.2 t -93.6 62.43 3.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.934 0.873 . . . . 0.0 111.859 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.6 p -162.53 98.27 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -150.39 141.86 23.42 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.781 1.277 . . . . 0.0 113.259 -170.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.496 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 62.5 m-85 -94.27 159.92 14.91 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.141 169.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.15 -124.95 2.52 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.378 -175.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.85 77.45 10.09 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.644 1.211 . . . . 0.0 110.281 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.653 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 96.4 mtp -73.42 -64.02 1.07 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.183 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.477 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 30.1 t70 -138.44 44.5 2.1 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.666 0.746 . . . . 0.0 109.367 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 86.5 m -153.35 -176.81 5.96 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.92 0.867 . . . . 0.0 110.76 -171.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -79.84 -177.68 6.06 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.245 1.021 . . . . 0.0 112.754 -170.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -60.89 -56.86 16.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -77.12 -4.41 44.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -175.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -108.58 153.01 23.98 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.166 -0.959 . . . . 0.0 109.334 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -140.19 153.56 46.65 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.641 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 35.7 m -91.07 124.22 35.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.246 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.0 t -79.15 155.88 28.49 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.304 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 121.501 0.667 . . . . 0.0 110.895 -169.704 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 98.2 mttt . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.408 ' OE1' ' SD ' ' A' ' 28' ' ' MET . 46.0 tt0 -76.67 -44.62 33.07 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.382 -0.824 . . . . 0.0 112.995 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -66.15 -38.6 88.52 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.797 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -63.31 -31.12 72.18 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -62.96 -44.17 96.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.838 -0.539 . . . . 0.0 112.156 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -70.65 -45.88 64.31 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.495 -0.753 . . . . 0.0 111.737 172.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.77 83.93 0.9 Allowed Glycine 0 N--CA 1.468 0.781 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.06 -166.58 24.26 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 119.577 -1.296 . . . . 0.0 112.222 -175.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -147.05 152.15 38.07 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.761 0.791 . . . . 0.0 108.986 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.1 m -79.8 123.99 28.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.054 -0.658 . . . . 0.0 110.177 175.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 37' ' ' CYS . 96.9 m-85 -126.35 148.36 63.6 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 175.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.13 156.66 19.7 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 121.592 1.528 . . . . 0.0 112.08 171.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -62.4 -31.16 71.8 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -99.25 -23.1 15.31 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -89.7 -161.22 0.76 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.529 -0.732 . . . . 0.0 111.75 -168.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.0 mt -79.1 139.19 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 122.707 1.242 . . . . 0.0 112.774 -169.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.2 t -116.02 144.48 44.05 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 166.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -141.65 110.58 6.23 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 119.461 -0.896 . . . . 0.0 108.866 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.99 154.4 87.81 Favored 'Cis proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.531 -1.445 . . . . 0.0 111.622 0.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -77.68 -33.53 2.27 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 121.273 1.315 . . . . 0.0 115.123 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.6 m -93.18 66.06 4.01 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.384 -0.823 . . . . 0.0 111.044 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.495 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 55.4 m -163.74 74.64 0.33 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -101.33 141.85 33.59 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.548 1.166 . . . . 0.0 111.521 -172.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -117.59 152.45 35.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.031 175.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -76.03 -148.19 2.24 Favored Glycine 0 N--CA 1.47 0.967 0 C-N-CA 119.684 -1.246 . . . . 0.0 112.894 -173.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -81.11 95.29 6.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.815 1.293 . . . . 0.0 108.874 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.656 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 25.4 mmm -98.48 -74.52 0.58 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.844 -171.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -146.58 61.3 1.21 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 74.0 m -129.97 -103.0 0.3 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -149.27 -171.55 3.91 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.398 -0.814 . . . . 0.0 109.203 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -60.16 -55.98 27.22 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -171.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -94.41 10.83 32.84 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -109.85 164.74 12.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.445 1.117 . . . . 0.0 110.082 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -130.21 159.39 37.0 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.17 -176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 43.9 m -90.01 157.08 17.98 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.102 -1.039 . . . . 0.0 108.768 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 23' ' ' SER . 11.1 t -158.23 -178.83 7.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.894 0.854 . . . . 0.0 109.105 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 tptm . . . . . 0 C--N 1.325 -0.491 0 CA-C-O 121.829 0.823 . . . . 0.0 110.227 -174.352 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.1 tptm . . . . . 0 N--CA 1.47 0.537 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -79.0 -55.51 5.07 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.719 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 77.8 m -62.98 -29.11 70.56 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.06 -29.55 67.7 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.303 -0.873 . . . . 0.0 112.494 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -58.7 -50.77 72.65 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.653 -0.655 . . . . 0.0 111.46 173.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.0 -47.11 81.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.303 172.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 103.61 55.84 0.78 Allowed Glycine 0 N--CA 1.468 0.791 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.466 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.69 -152.29 7.69 Favored Glycine 0 N--CA 1.468 0.803 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -150.47 148.72 29.07 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.17 0.986 . . . . 0.0 109.992 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.5 t -80.92 113.81 19.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.785 0.802 . . . . 0.0 110.786 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -124.73 157.65 65.18 Favored Pre-proline 0 N--CA 1.471 0.579 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.556 178.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -58.77 157.88 26.5 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.849 1.7 . . . . 0.0 113.793 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -63.27 -27.85 69.62 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.91 -30.37 58.75 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -74.48 154.48 38.69 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.228 1.013 . . . . 0.0 111.197 -171.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.0 mt -79.47 124.48 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 122.022 0.915 . . . . 0.0 111.077 -169.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.418 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 49.4 t -95.49 140.51 30.24 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 169.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.21 119.31 29.67 Favored Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.03 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 166.77 82.06 Favored 'Cis proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.402 -1.499 . . . . 0.0 111.419 1.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -51.36 -49.81 15.95 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 122.098 1.865 . . . . 0.0 115.464 -172.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.9 p -92.58 56.73 2.77 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.638 0.732 . . . . 0.0 111.818 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.8 m -145.34 69.89 1.25 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 122.426 1.108 . . . . 0.0 109.574 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.418 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 5.1 p30 -144.27 151.42 39.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.083 0.944 . . . . 0.0 109.12 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.625 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 36.1 m-85 -98.04 170.2 9.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.608 0.718 . . . . 0.0 109.07 175.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.08 -142.82 3.47 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.673 -1.251 . . . . 0.0 112.441 -171.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -79.16 81.98 5.37 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.782 1.277 . . . . 0.0 109.57 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.719 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 95.1 mtp -82.17 -111.02 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.466 -178.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -91.24 64.13 5.14 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 t -142.64 169.71 17.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -169.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 51.0 ttt85 -67.75 166.44 15.31 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.321 -0.862 . . . . 0.0 110.753 -177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -51.29 -46.84 62.62 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -108.88 28.23 8.67 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.238 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -111.51 168.91 9.18 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.301 -0.874 . . . . 0.0 109.347 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -135.46 149.1 49.47 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.484 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.7 m -89.48 114.91 26.48 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.803 0.811 . . . . 0.0 109.56 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 50.0 t -84.98 126.77 33.8 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.944 0.878 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 57.0 tptt . . . . . 0 C--N 1.324 -0.501 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -176.887 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 122.412 1.101 . . . . 0.0 113.139 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -68.75 -52.22 32.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.175 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.0 t -68.21 -29.54 68.41 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.351 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -68.76 -30.14 68.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.908 174.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -67.01 -36.24 81.7 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -82.47 -53.32 6.08 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.004 174.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.64 81.83 0.14 Allowed Glycine 0 N--CA 1.467 0.708 0 C-N-CA 119.992 -1.099 . . . . 0.0 110.582 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.75 170.33 40.5 Favored Glycine 0 N--CA 1.468 0.773 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.98 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -132.03 155.02 48.76 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.2 m -81.29 136.57 35.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.814 0.816 . . . . 0.0 112.282 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -134.1 149.63 72.02 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.05 173.49 0.9 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 121.885 1.724 . . . . 0.0 114.019 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.25 -48.9 16.3 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.524 -0.735 . . . . 0.0 111.487 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -29.88 70.95 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -86.42 137.52 32.49 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.727 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.4 mt -100.5 133.55 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 CA-C-O 121.795 0.807 . . . . 0.0 110.813 -170.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 p -102.39 149.51 24.29 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.4 tp -117.61 131.06 24.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -174.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.7 160.54 90.67 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.207 1.467 . . . . 0.0 113.363 5.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -85.19 -30.6 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 121.254 1.303 . . . . 0.0 113.996 -169.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.5 m -93.45 52.62 1.76 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.312 -0.868 . . . . 0.0 110.771 178.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -150.23 77.88 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.65 0.738 . . . . 0.0 109.193 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -157.95 158.9 35.85 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.311 1.053 . . . . 0.0 111.245 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.446 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 57.7 m-85 -99.66 170.04 8.85 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.342 -0.845 . . . . 0.0 109.645 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.09 -133.76 4.39 Favored Glycine 0 N--CA 1.47 0.902 0 C-N-CA 119.806 -1.188 . . . . 0.0 112.907 -170.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -84.92 86.88 7.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.16 0.981 . . . . 0.0 108.471 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.446 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 74.1 mtp -84.5 -76.26 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.894 -171.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -128.72 12.02 6.26 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 79.9 m -114.1 -157.78 0.64 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.62 -0.675 . . . . 0.0 109.578 178.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -78.88 -178.87 6.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.377 1.084 . . . . 0.0 111.92 -171.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -63.51 -49.06 75.02 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -176.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -91.22 18.54 6.84 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -113.84 156.17 24.4 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -135.17 157.2 47.52 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.081 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.5 t -98.39 107.93 20.51 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.808 -176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.0 t -97.33 148.64 22.93 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.284 1.04 . . . . 0.0 111.571 -172.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.2 tttp . . . . . 0 N--CA 1.467 0.396 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.909 176.66 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 51.5 tptt . . . . . 0 N--CA 1.469 0.494 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.19 -49.88 14.19 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.342 -173.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.6 t -77.36 -28.65 53.0 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -70.77 -33.84 71.18 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.135 -0.978 . . . . 0.0 112.832 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -76.91 -39.36 51.13 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.726 -0.609 . . . . 0.0 111.629 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -71.75 -35.63 70.17 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.498 -0.751 . . . . 0.0 112.299 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.22 90.66 2.0 Favored Glycine 0 N--CA 1.47 0.934 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.824 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.1 146.25 9.78 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 119.52 -1.324 . . . . 0.0 112.324 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -101.57 143.8 31.11 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 175.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HE3' ' A' ' 34' ' ' TRP . 42.3 t -85.54 131.32 34.39 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.361 -0.837 . . . . 0.0 111.864 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -132.73 154.08 81.32 Favored Pre-proline 0 N--CA 1.471 0.62 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.79 163.47 15.91 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.836 1.69 . . . . 0.0 111.599 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.67 -4.62 16.3 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.33 -21.16 42.78 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -87.16 152.26 22.48 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.028 0.918 . . . . 0.0 112.57 -169.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -83.2 135.92 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 121.822 0.82 . . . . 0.0 109.05 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -96.09 119.16 34.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.726 0.774 . . . . 0.0 110.509 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.7 tp -121.35 134.36 24.47 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.88 168.33 76.85 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 123.676 -1.385 . . . . 0.0 111.72 2.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -58.53 -51.07 7.97 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.606 1.537 . . . . 0.0 114.777 -170.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 70.5 m -90.5 58.91 4.12 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.616 0.722 . . . . 0.0 111.468 -177.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.9 m -162.48 83.2 0.54 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.14 0.971 . . . . 0.0 108.672 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -157.33 160.8 38.87 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.61 0.719 . . . . 0.0 109.104 -171.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.9 m-85 -135.54 163.96 28.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.816 0.817 . . . . 0.0 110.14 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.05 -143.31 5.65 Favored Glycine 0 N--CA 1.47 0.911 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.093 -176.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -77.68 98.4 5.46 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.317 1.055 . . . . 0.0 109.016 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.554 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 85.2 mtp -90.19 -113.63 0.07 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.584 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -110.62 68.64 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.8 t -142.26 -88.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -141.47 155.37 45.84 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -55.85 -34.15 65.17 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -109.49 15.34 23.04 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.42 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 33.0 m0 -113.4 161.57 17.14 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.058 -1.026 . . . . 0.0 109.505 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -113.42 170.95 7.87 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.362 0.601 . . . . 0.0 110.364 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.9 t -119.92 97.15 5.47 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.443 -0.785 . . . . 0.0 109.174 173.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 43.3 t -86.12 150.54 24.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.768 0.794 . . . . 0.0 111.545 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt . . . . . 0 N--CA 1.466 0.362 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.7 179.993 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt . . . . . 0 N--CA 1.468 0.455 0 CA-C-O 120.643 0.259 . . . . 0.0 111.291 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -77.38 -47.89 18.7 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.563 -0.71 . . . . 0.0 112.47 -174.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.7 t -62.99 -30.29 71.48 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -76.96 -38.09 53.94 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.459 -0.776 . . . . 0.0 112.092 174.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -69.82 -42.48 73.6 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.593 -0.692 . . . . 0.0 112.504 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -71.69 -63.02 1.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.316 -0.865 . . . . 0.0 111.235 177.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.84 83.7 0.05 OUTLIER Glycine 0 N--CA 1.467 0.723 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.627 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.19 163.76 37.43 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.664 -1.255 . . . . 0.0 111.242 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -123.78 147.28 47.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.6 m -78.47 125.28 29.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.755 0.788 . . . . 0.0 110.716 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -132.98 156.56 79.95 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.8 136.72 77.97 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.898 1.732 . . . . 0.0 112.294 175.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -76.87 -29.59 55.87 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -172.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.13 -28.26 69.94 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 172.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -81.52 144.76 31.09 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.096 0.95 . . . . 0.0 109.279 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -87.71 133.92 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.864 0.84 . . . . 0.0 111.203 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 57.7 m -74.67 131.08 40.59 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 168.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.51 116.58 31.94 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.79 163.49 85.88 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.482 -1.466 . . . . 0.0 112.56 7.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -72.01 -27.06 17.75 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.892 1.728 . . . . 0.0 113.834 -175.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.3 p -71.1 -28.92 64.66 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.51 -0.744 . . . . 0.0 112.804 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -84.46 81.9 8.64 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.483 -0.761 . . . . 0.0 109.395 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -150.29 130.38 13.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 122.575 1.179 . . . . 0.0 111.058 -173.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.613 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 26.9 m-85 -106.4 152.24 23.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.327 173.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.56 -133.92 3.67 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.914 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -80.52 83.89 6.23 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.754 1.264 . . . . 0.0 110.213 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.613 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 94.1 mtp -81.17 -69.1 0.63 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.857 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -151.72 57.65 0.86 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 84.9 m -123.32 -105.36 0.36 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -155.17 -169.21 3.1 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.349 -0.844 . . . . 0.0 109.114 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 45.7 t-105 -60.99 -51.76 67.88 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.31 -0.869 . . . . 0.0 112.987 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -85.58 -0.07 53.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -120.23 150.92 39.91 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.803 1.183 . . . . 0.0 109.767 -177.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -134.21 177.21 7.92 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.132 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -103.46 136.76 42.6 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.076 -1.015 . . . . 0.0 110.951 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 79.6 m -84.49 142.05 30.33 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt . . . . . 0 N--CA 1.469 0.487 0 CA-C-O 122.019 0.914 . . . . 0.0 110.391 -176.009 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -78.49 -44.5 24.32 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.39 -40.75 95.49 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -71.32 -36.43 71.58 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.635 -0.666 . . . . 0.0 112.213 176.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -67.64 -38.04 83.29 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -72.39 -51.75 19.04 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.178 -0.952 . . . . 0.0 111.629 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.58 72.91 0.03 OUTLIER Glycine 0 N--CA 1.467 0.752 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.113 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.52 -174.16 42.76 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 119.522 -1.323 . . . . 0.0 112.24 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -143.82 153.06 41.98 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.03 119.12 21.71 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.986 0.898 . . . . 0.0 110.773 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.89 152.38 75.24 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -60.03 168.93 5.3 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 121.49 1.46 . . . . 0.0 113.882 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -58.73 -51.39 70.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.373 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.0 -26.97 69.1 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.05 134.33 42.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 122.162 0.982 . . . . 0.0 109.969 176.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.1 mt -85.19 132.24 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-O 121.821 0.82 . . . . 0.0 111.356 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 94.0 m -78.23 136.52 37.8 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.8 117.93 30.84 Favored Pre-proline 0 N--CA 1.469 0.505 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.406 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 59.1 Cg_endo -80.32 166.24 76.48 Favored 'Cis proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.269 -1.555 . . . . 0.0 112.846 8.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 74.1 Cg_exo -59.35 -39.49 76.68 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 121.922 1.748 . . . . 0.0 115.102 -173.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -90.06 59.43 4.5 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.976 0.893 . . . . 0.0 110.823 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.3 t -161.27 85.75 0.67 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.444 ' OD1' ' SG ' ' A' ' 18' ' ' CYS . 27.8 t70 -157.23 126.68 6.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.743 -0.783 . . . . 0.0 109.572 -169.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -83.12 154.03 24.53 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.77 -129.87 1.16 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 119.68 -1.248 . . . . 0.0 112.092 -174.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -84.23 94.97 8.53 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.784 0.802 . . . . 0.0 108.981 177.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 40.9 mmm -89.5 -77.52 0.38 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.994 -172.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -145.86 43.85 1.26 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.777 0.799 . . . . 0.0 111.454 -176.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 88.5 m -134.11 -151.21 0.43 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -83.04 -178.61 7.18 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.622 -1.299 . . . . 0.0 111.567 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.1 t-105 -57.95 -54.09 50.91 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -92.98 25.26 3.28 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -114.16 154.89 27.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 122.394 1.092 . . . . 0.0 110.012 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -120.29 164.1 16.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.965 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.6 t -110.85 112.19 23.87 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 169.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -78.62 143.8 36.06 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.238 -173.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.929 174.74 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -78.19 -49.48 13.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.3 t -68.0 -33.66 75.04 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.439 -0.904 . . . . 0.0 113.199 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.06 -30.51 70.59 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.028 -0.669 . . . . 0.0 112.751 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -66.4 -44.34 83.28 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.908 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.58 -50.43 11.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.748 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.25 92.27 0.44 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 120.022 -1.085 . . . . 0.0 110.85 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.99 172.13 42.11 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.954 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -130.87 143.31 50.64 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 m -78.16 128.56 33.97 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.343 1.068 . . . . 0.0 110.967 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -132.14 147.35 65.45 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.98 149.2 63.43 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 121.411 1.407 . . . . 0.0 112.213 175.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.93 -29.43 69.61 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -64.31 -25.06 67.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -79.06 150.48 31.86 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.481 -0.762 . . . . 0.0 110.374 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -78.42 113.42 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 122.055 0.931 . . . . 0.0 110.643 -173.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 42.5 t -85.43 124.49 32.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 169.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -125.81 116.57 24.39 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.42 163.7 89.69 Favored 'Cis proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.44 -1.483 . . . . 0.0 112.019 5.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.62 -29.82 60.65 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.97 1.78 . . . . 0.0 114.25 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 93.1 p -96.93 50.46 1.1 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.576 -0.703 . . . . 0.0 111.803 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 92.1 p -152.11 78.53 1.23 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.371 1.082 . . . . 0.0 109.626 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.4 p30 -156.84 158.14 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 122.192 0.996 . . . . 0.0 108.827 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.449 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 88.3 m-85 -91.53 174.01 7.59 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 170.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -137.73 5.69 Favored Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.313 -1.422 . . . . 0.0 111.09 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -79.48 97.98 6.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.942 0.877 . . . . 0.0 108.874 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 61.2 mtp -89.34 -121.4 0.05 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.114 -172.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.54 48.51 1.15 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.369 -0.832 . . . . 0.0 110.808 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 99.8 m -131.53 -93.39 0.39 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -157.54 -176.1 5.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.824 -1.173 . . . . 0.0 112.482 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -60.39 -55.46 33.25 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -90.55 23.36 3.05 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -175.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -119.93 142.75 48.45 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.099 -1.001 . . . . 0.0 109.474 177.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -113.88 157.96 21.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.683 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.402 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 4.3 t -100.51 107.13 18.75 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.955 174.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 46.4 t -81.5 142.81 32.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 122.143 0.973 . . . . 0.0 111.095 -172.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt . . . . . 0 C--N 1.326 -0.435 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.954 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt . . . . . 0 N--CA 1.47 0.55 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -78.4 -51.65 9.73 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -171.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.6 t -65.97 -29.96 70.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -76.03 -32.46 59.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.489 -0.757 . . . . 0.0 112.567 175.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -68.39 -45.35 72.93 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.83 -0.544 . . . . 0.0 112.065 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -78.54 -28.44 46.1 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.638 -0.663 . . . . 0.0 112.579 176.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.99 60.83 0.71 Allowed Glycine 0 N--CA 1.468 0.822 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.372 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.6 157.07 17.99 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -107.51 140.01 41.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.11 129.96 35.0 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.631 0.729 . . . . 0.0 111.096 -177.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -141.55 159.83 58.94 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -63.32 144.14 90.66 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 121.736 1.624 . . . . 0.0 112.737 176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -73.9 -55.09 6.6 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.468 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.15 -30.51 70.43 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -92.67 169.66 10.33 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 122.14 0.971 . . . . 0.0 109.968 174.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.6 mt -74.67 124.67 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 121.518 -0.739 . . . . 0.0 111.187 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -100.15 144.44 29.17 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 169.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -119.33 117.82 32.88 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.72 162.65 74.78 Favored 'Cis proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.641 9.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -88.34 -55.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 121.128 1.219 . . . . 0.0 113.398 -169.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 97.3 p -85.6 48.9 1.66 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.601 -0.687 . . . . 0.0 112.574 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 79.0 p -167.81 72.51 0.11 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -134.87 153.7 51.95 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.9 1.333 . . . . 0.0 112.513 -169.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.515 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 73.3 m-85 -94.7 164.31 13.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.938 173.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.29 -138.85 5.76 Favored Glycine 0 N--CA 1.468 0.832 0 C-N-CA 119.987 -1.101 . . . . 0.0 112.029 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -82.22 90.09 6.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.962 0.887 . . . . 0.0 108.892 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.515 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 88.6 mtp -86.01 -86.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -175.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -140.72 50.6 1.66 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 122.052 0.93 . . . . 0.0 109.223 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 85.9 m -98.98 -90.92 0.29 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -150.21 -179.88 7.54 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -57.99 -54.85 42.22 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.826 -1.171 . . . . 0.0 113.332 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -94.96 11.78 30.68 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -105.94 162.84 13.23 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 120.364 -1.46 . . . . 0.0 111.209 -174.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 61.2 pttt -144.12 171.87 13.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.164 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.3 m -104.1 145.93 29.47 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.099 -1.0 . . . . 0.0 110.587 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -130.47 155.68 46.05 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.475 -0.766 . . . . 0.0 109.999 173.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.3 -174.286 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.662 0.268 . . . . 0.0 111.609 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.31 -48.33 15.9 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -171.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.31 -39.65 89.46 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -70.54 -37.18 74.03 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -67.73 -43.6 79.58 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.444 -0.785 . . . . 0.0 112.585 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.99 -50.59 40.03 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.951 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.79 72.56 0.07 OUTLIER Glycine 0 N--CA 1.467 0.748 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.933 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.98 152.52 17.48 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 119.533 -1.317 . . . . 0.0 111.484 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -109.23 152.16 25.55 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.751 0.786 . . . . 0.0 109.577 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -79.87 126.18 30.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.17 0.986 . . . . 0.0 111.539 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -130.59 146.56 62.36 Favored Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.22 172.62 2.37 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 121.587 1.525 . . . . 0.0 113.106 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -68.2 -41.25 81.65 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 1.6 pm0 -75.88 -25.49 56.17 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -70.24 138.9 52.06 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 122.084 0.945 . . . . 0.0 110.091 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.8 mt -78.82 120.98 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 122.143 0.973 . . . . 0.0 110.642 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 43.5 t -85.65 126.3 33.82 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 169.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.27 116.5 30.94 Favored Pre-proline 0 N--CA 1.469 0.496 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -172.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.46 162.44 90.51 Favored 'Cis proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.464 5.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -70.14 -32.05 17.73 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.929 1.752 . . . . 0.0 114.132 -172.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.4 m -91.63 60.2 3.96 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.017 175.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -165.99 71.01 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.968 0.89 . . . . 0.0 109.206 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.488 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 3.3 p30 -154.56 151.61 29.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.837 0.827 . . . . 0.0 108.968 178.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -93.02 174.19 7.36 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.601 -0.84 . . . . 0.0 108.901 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.24 -134.79 3.77 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 119.748 -1.215 . . . . 0.0 110.936 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.65 123.76 25.45 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 78.8 mmm -117.98 -95.39 0.48 Allowed 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.249 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -130.55 54.66 1.87 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 122.058 0.932 . . . . 0.0 109.852 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.6 m -144.85 -77.8 0.2 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.161 -0.615 . . . . 0.0 109.62 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -145.46 164.35 31.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.735 0.779 . . . . 0.0 109.539 -173.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -61.62 -49.37 76.85 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -102.31 30.57 4.47 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -114.24 154.37 28.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.121 -0.987 . . . . 0.0 109.051 175.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -114.93 160.57 19.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.913 0.863 . . . . 0.0 111.58 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.72 103.78 13.14 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 44.4 t -79.66 148.61 31.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 122.211 1.005 . . . . 0.0 111.282 -172.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? . . . . . 0 C--N 1.325 -0.487 0 CA-C-O 121.787 0.803 . . . . 0.0 109.665 -175.839 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 tptp . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.568 0.223 . . . . 0.0 111.289 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -78.77 -50.19 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -175.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.85 -36.03 81.92 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -75.94 -32.69 59.67 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 112.693 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -66.26 -42.36 88.64 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.73 -0.606 . . . . 0.0 112.072 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -69.33 -48.35 61.67 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.579 -0.849 . . . . 0.0 110.66 171.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.72 92.88 1.41 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -174.52 170.31 43.4 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 118.912 -1.613 . . . . 0.0 112.709 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -131.0 153.63 49.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 99.2 m -79.42 120.49 23.9 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 122.069 0.937 . . . . 0.0 110.992 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -116.81 154.28 49.44 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 171.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -60.97 172.55 2.91 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 121.393 1.395 . . . . 0.0 113.94 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -62.39 -44.78 95.63 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.84 -27.28 69.06 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -174.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -75.55 141.17 43.02 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.295 1.045 . . . . 0.0 111.26 -170.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.1 mt -81.51 133.46 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 121.948 0.88 . . . . 0.0 109.611 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 23' ' ' SER . 35.4 t -84.56 133.07 34.45 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.62 115.17 13.45 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -176.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -74.47 164.33 88.23 Favored 'Cis proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.309 -1.538 . . . . 0.0 111.947 4.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.51 -13.95 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 121.767 1.644 . . . . 0.0 114.48 -171.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 48.2 m -71.22 -24.0 62.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 177.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 69.0 m -100.42 50.02 0.9 Allowed 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.673 -0.642 . . . . 0.0 111.574 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -101.94 100.13 10.39 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 24.8 m-85 -99.28 159.6 14.88 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.571 -174.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.15 -144.94 2.48 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 119.717 -1.23 . . . . 0.0 112.121 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -82.2 74.72 9.16 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.449 1.119 . . . . 0.0 110.577 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.55 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 95.6 mtp -71.18 -79.61 0.07 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.505 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.05 52.95 0.72 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 169.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.2 m -132.52 173.39 11.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.802 0.811 . . . . 0.0 109.946 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -79.96 -165.78 0.89 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.4 t-105 -52.48 -64.27 0.87 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -101.51 16.58 25.23 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -98.09 160.16 14.48 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.532 -1.355 . . . . 0.0 110.821 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -124.76 141.31 52.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.641 -169.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.35 122.42 30.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.9 t -128.35 144.58 51.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.618 0.723 . . . . 0.0 110.159 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp . . . . . 0 N--CA 1.468 0.427 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.513 176.196 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.42 -46.99 18.51 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.995 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.1 t -72.14 -29.15 63.77 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -64.99 -29.14 70.04 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.274 -0.891 . . . . 0.0 112.49 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -55.71 -45.26 77.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.432 -0.507 . . . . 0.0 111.937 173.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -76.88 -45.23 28.94 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.545 -0.722 . . . . 0.0 111.184 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.91 64.94 0.29 Allowed Glycine 0 N--CA 1.469 0.894 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.336 173.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.46 158.44 28.97 Favored Glycine 0 N--CA 1.467 0.761 0 C-N-CA 119.613 -1.279 . . . . 0.0 111.745 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -102.77 158.97 15.88 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.629 0.728 . . . . 0.0 109.759 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.0 m -79.34 138.58 37.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.106 0.955 . . . . 0.0 110.858 177.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.92 159.09 72.46 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -59.24 141.68 98.19 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.78 1.653 . . . . 0.0 113.237 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -72.06 -45.0 62.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.061 -0.655 . . . . 0.0 112.49 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.35 -28.78 67.15 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -174.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -94.36 158.64 15.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.196 0.998 . . . . 0.0 110.349 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.0 mt -83.89 132.67 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-O 121.817 0.817 . . . . 0.0 110.437 -172.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.34 137.57 32.21 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 169.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -115.44 118.57 39.35 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 72.0 Cg_endo -84.39 161.66 67.75 Favored 'Cis proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.425 -1.489 . . . . 0.0 112.49 8.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 47.1 Cg_exo -66.63 -39.46 15.76 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.617 1.545 . . . . 0.0 114.391 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 56.0 m -67.62 -36.92 81.74 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 m -85.05 78.63 9.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.76 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -143.09 150.83 40.03 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.414 1.102 . . . . 0.0 110.187 -171.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.592 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 32.5 m-85 -125.95 154.94 42.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.35 -175.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.31 -138.69 4.55 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.285 -172.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.92 85.5 6.21 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 122.018 0.913 . . . . 0.0 109.098 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.592 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 82.7 mtp -84.88 -108.66 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -177.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -108.23 66.8 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 171.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 90.2 m -129.06 -175.65 3.62 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.19 0.995 . . . . 0.0 111.015 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -77.96 170.59 16.34 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.676 0.751 . . . . 0.0 110.669 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -53.53 -55.53 24.75 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.8 mtm105 -94.52 22.93 5.66 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.577 177.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -116.96 159.6 22.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.535 1.159 . . . . 0.0 109.353 178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -133.85 173.05 11.96 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.776 176.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB3' ' HB2' ' A' ' 25' ' ' PHE . 5.8 t -99.69 155.02 17.84 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.912 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -148.56 150.93 34.2 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.541 -0.864 . . . . 0.0 109.536 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.3 tttt . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 121.916 0.865 . . . . 0.0 110.089 -179.561 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 95.5 mttt . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 120.676 0.274 . . . . 0.0 111.011 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -76.15 -38.75 56.35 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.431 -0.793 . . . . 0.0 112.14 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.4 t -55.41 -37.53 67.76 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -72.18 -39.09 68.93 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.723 -0.611 . . . . 0.0 112.279 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -66.27 -41.35 90.0 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.827 -0.546 . . . . 0.0 112.398 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -66.01 -38.55 88.74 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.423 -0.798 . . . . 0.0 111.656 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.16 83.84 1.7 Allowed Glycine 0 N--CA 1.467 0.734 0 C-N-CA 120.267 -0.968 . . . . 0.0 111.458 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.78 148.31 10.02 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.307 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -83.46 154.82 23.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.596 0.712 . . . . 0.0 109.183 175.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 37.2 m -78.76 125.3 29.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.724 -0.79 . . . . 0.0 110.133 177.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -128.98 148.34 68.56 Favored Pre-proline 0 N--CA 1.468 0.475 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.633 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -56.95 166.9 3.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.934 1.756 . . . . 0.0 113.55 173.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -61.67 -37.83 85.53 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.54 -20.13 66.21 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -176.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -75.69 124.46 27.28 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.381 -0.824 . . . . 0.0 111.106 -175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.3 mt -74.28 137.09 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.091 0.948 . . . . 0.0 109.638 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 33.5 t -88.56 123.95 33.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.0 tp -134.11 125.24 17.91 Favored Pre-proline 0 CA--C 1.538 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -70.46 167.14 73.97 Favored 'Cis proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.048 -1.647 . . . . 0.0 114.165 7.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -66.97 -30.13 39.84 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.702 1.601 . . . . 0.0 114.711 -171.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.6 m -69.35 -43.19 74.12 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -172.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -90.02 73.28 7.35 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.51 -0.744 . . . . 0.0 111.652 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -123.19 132.66 54.14 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -117.85 148.56 42.0 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.37 0.605 . . . . 0.0 109.45 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.64 -124.74 2.04 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.882 -175.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.97 113.12 16.83 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.3 mmm -117.91 -93.18 0.52 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -171.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -138.07 59.95 1.64 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 75.1 m -123.28 -88.93 0.61 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -179.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -159.54 -168.85 2.4 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 62.0 t-105 -61.95 -50.64 71.31 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -173.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -102.13 21.28 15.15 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -118.35 164.39 15.29 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 122.601 1.191 . . . . 0.0 110.304 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -132.81 178.8 6.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.702 -178.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 12.8 m -118.27 145.22 45.21 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.917 0.865 . . . . 0.0 109.752 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.8 t -141.89 141.36 33.02 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.904 0.859 . . . . 0.0 109.784 178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 tttm . . . . . 0 N--CA 1.468 0.453 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.277 175.931 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp . . . . . 0 N--CA 1.468 0.471 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -76.93 -49.02 16.52 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.734 -0.786 . . . . 0.0 112.533 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.9 t -75.13 -31.02 60.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.344 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -68.88 -29.1 67.32 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.366 -0.834 . . . . 0.0 111.958 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -61.61 -39.86 92.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.494 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -75.13 -45.53 40.4 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.38 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.89 91.14 1.37 Allowed Glycine 0 N--CA 1.466 0.639 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.34 -176.24 39.14 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 118.845 -1.645 . . . . 0.0 112.91 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -138.91 145.29 39.68 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.7 m -90.86 143.8 26.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.642 1.21 . . . . 0.0 112.232 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -141.47 158.82 62.63 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.374 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.54 164.13 3.25 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.821 1.681 . . . . 0.0 113.493 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.17 -22.57 62.95 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.57 -24.45 39.19 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -176.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -74.43 142.92 44.92 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.98 0.895 . . . . 0.0 110.821 -176.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.8 mt -82.0 131.81 32.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.92 0.867 . . . . 0.0 109.676 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 95.8 m -98.33 102.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 169.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.404 HD12 ' HD3' ' A' ' 21' ' ' PRO . 18.5 tp -110.38 133.61 21.05 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 163.31 86.11 Favored 'Cis proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.383 5.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HD3' HD12 ' A' ' 19' ' ' LEU . 50.8 Cg_endo -69.92 -24.33 29.07 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.645 1.563 . . . . 0.0 113.599 -171.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p -87.62 49.44 1.81 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 122.056 0.932 . . . . 0.0 110.49 174.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 t -150.91 51.4 0.86 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' SG ' ' A' ' 37' ' ' CYS . 32.3 t70 -140.64 129.19 22.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.652 0.739 . . . . 0.0 109.291 -171.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -116.21 162.12 17.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.9 -145.56 5.9 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 119.231 -1.461 . . . . 0.0 111.546 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -78.81 101.72 7.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.268 1.032 . . . . 0.0 108.952 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.409 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 90.9 mtp -96.92 -118.81 0.12 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -96.81 62.77 1.93 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.0 0.905 . . . . 0.0 108.719 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 50.3 m -146.92 -160.97 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.519 0.676 . . . . 0.0 110.301 -174.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -71.21 157.17 38.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.185 0.993 . . . . 0.0 110.913 -174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -56.79 -50.22 72.99 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.68 12.1 31.02 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.858 -177.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -108.82 172.0 7.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.378 -0.826 . . . . 0.0 108.868 175.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -139.59 173.82 11.14 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.626 -0.829 . . . . 0.0 110.591 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.409 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.8 t -109.44 153.08 24.53 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.557 -177.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 89.2 m -139.43 157.79 45.25 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt . . . . . 0 C--N 1.326 -0.454 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.997 -179.814 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.3 tptm . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -74.11 -60.59 2.19 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.636 -0.826 . . . . 0.0 112.372 -170.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.6 t -78.37 -36.3 46.21 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.994 -1.066 . . . . 0.0 112.318 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -65.82 -37.37 86.07 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.061 -0.656 . . . . 0.0 112.404 -174.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -78.96 -29.82 44.17 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.065 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -79.36 -59.68 2.66 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.258 -0.902 . . . . 0.0 110.254 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.09 90.6 0.15 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 119.724 -1.227 . . . . 0.0 111.245 176.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.69 -177.13 40.5 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 119.017 -1.563 . . . . 0.0 112.68 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -138.17 150.35 46.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m -82.1 136.95 35.11 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 122.117 0.96 . . . . 0.0 112.354 -176.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -139.04 147.34 53.31 Favored Pre-proline 0 N--CA 1.467 0.398 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.9 148.21 48.01 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 121.729 1.619 . . . . 0.0 112.338 173.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -70.48 -45.05 66.45 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.553 -174.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.19 -33.58 74.81 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.31 147.89 29.66 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.974 0.893 . . . . 0.0 109.835 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -86.78 133.79 29.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.221 1.01 . . . . 0.0 111.303 -169.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.9 m -77.61 133.68 38.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.353 170.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.26 113.95 13.5 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -176.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.89 159.09 80.23 Favored 'Cis proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.184 -1.59 . . . . 0.0 112.627 10.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -93.9 48.52 0.31 Allowed 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 121.58 1.52 . . . . 0.0 111.123 -173.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -74.62 -41.35 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.172 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -149.3 120.13 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.625 -0.83 . . . . 0.0 109.864 -173.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -114.85 104.51 12.02 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.89 0.852 . . . . 0.0 109.536 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.7 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 63.6 m-85 -79.2 162.94 25.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.065 0.936 . . . . 0.0 110.354 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.2 -126.99 5.27 Favored Glycine 0 N--CA 1.465 0.602 0 C-N-CA 119.64 -1.267 . . . . 0.0 111.741 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -82.12 96.82 7.91 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.004 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.7 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 71.2 mtp -108.36 -116.01 0.28 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -177.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.437 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 60.8 m-20 -91.11 53.51 2.37 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.129 169.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.5 m -135.55 171.98 13.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.998 0.904 . . . . 0.0 110.78 -173.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -64.56 166.14 9.0 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.654 0.74 . . . . 0.0 110.541 179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.5 t-105 -55.17 -51.96 64.85 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -174.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -96.03 24.29 5.69 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.463 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -111.23 -174.37 2.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 122.115 0.96 . . . . 0.0 108.811 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -150.2 166.99 28.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.24 -172.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.553 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 1.8 t -111.47 140.53 45.99 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.194 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.5 m -121.11 152.46 38.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.16 0.981 . . . . 0.0 110.588 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 115.31 -0.859 . . . . 0.0 108.831 -177.33 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.0 tptm . . . . . 0 N--CA 1.467 0.379 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.56 -59.97 2.56 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.252 -170.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.447 ' H ' ' HB2' ' A' ' 29' ' ' ASP . 14.1 t -77.37 -30.75 53.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.968 -172.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.41 -34.87 78.67 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.594 -0.691 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -70.25 -41.04 74.03 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.762 177.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -74.79 -57.86 3.65 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.992 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.53 84.67 0.07 OUTLIER Glycine 0 N--CA 1.465 0.595 0 C-N-CA 119.837 -1.173 . . . . 0.0 110.466 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.67 169.21 39.06 Favored Glycine 0 CA--C 1.525 0.694 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.542 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -128.56 128.11 43.63 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 36' ' ' CYS . 48.7 t -80.81 136.15 36.07 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.321 1.058 . . . . 0.0 111.796 -175.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -138.51 158.41 70.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.81 -1.087 . . . . 0.0 108.202 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HA ' ' CG ' ' A' ' 34' ' ' TRP . 54.5 Cg_exo -61.72 178.46 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 121.442 1.428 . . . . 0.0 114.123 -179.177 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -61.8 -44.94 95.87 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.431 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -63.55 -26.5 68.73 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -76.05 133.01 40.46 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.507 -173.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.1 mt -81.3 131.12 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.913 0.864 . . . . 0.0 110.051 -175.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -86.42 134.54 33.69 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -133.7 113.76 12.99 Favored Pre-proline 0 C--N 1.325 -0.491 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -177.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.19 160.69 96.04 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 123.397 -1.501 . . . . 0.0 112.239 5.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.37 -26.66 10.14 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 121.837 1.692 . . . . 0.0 113.268 -174.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 84.6 p -71.23 -24.92 62.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.436 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.7 m -91.99 71.49 5.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.825 0.821 . . . . 0.0 109.851 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -142.81 119.57 11.18 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.52 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 71.6 m-85 -83.81 176.32 9.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.796 177.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.39 -133.4 5.82 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 119.422 -1.371 . . . . 0.0 110.718 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -76.4 117.34 17.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.416 -0.913 . . . . 0.0 108.877 176.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.52 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 82.9 mtp -122.44 -106.3 0.36 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.625 -175.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.447 ' HB2' ' H ' ' A' ' 4' ' ' CYS . 15.5 t70 -95.4 50.67 1.26 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.545 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 p -157.47 -89.2 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.323 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -159.64 -173.39 4.11 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.643 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 18.3 t-105 -54.94 -62.46 1.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -83.71 1.55 42.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.484 -0.886 . . . . 0.0 112.927 -170.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.401 ' CG ' ' HA ' ' A' ' 13' ' ' PRO . 34.5 m0 -97.11 150.05 21.28 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.231 -0.918 . . . . 0.0 109.157 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.38 159.46 24.16 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.977 -174.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.428 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 8.8 t -111.24 116.2 30.63 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.257 175.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.28 126.68 33.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.851 0.834 . . . . 0.0 110.209 -175.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.7 tttt . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 121.882 0.849 . . . . 0.0 109.028 178.5 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 121.285 0.564 . . . . 0.0 109.827 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -77.35 -43.66 32.16 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.073 -177.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.47 ' SG ' ' SD ' ' A' ' 28' ' ' MET . 14.1 t -72.13 -29.1 63.73 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 119.237 -0.985 . . . . 0.0 113.553 -173.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -69.45 -31.67 70.13 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.329 -0.948 . . . . 0.0 111.404 176.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -66.15 -38.36 87.91 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.341 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -74.78 -49.18 21.77 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.271 175.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.89 80.31 0.46 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.69 169.58 42.07 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 119.023 -1.56 . . . . 0.0 112.757 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -118.99 150.22 40.31 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.6 m -80.46 137.42 36.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.198 0.999 . . . . 0.0 111.329 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -133.75 137.67 29.19 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.54 165.96 8.71 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 C-N-CA 121.548 1.499 . . . . 0.0 112.344 175.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -77.77 86.07 4.05 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.98 0.895 . . . . 0.0 109.602 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 -27.74 0.24 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.263 -176.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -127.54 169.66 13.46 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.993 1.378 . . . . 0.0 112.533 -171.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.0 mt -77.95 137.17 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.3 t -86.54 117.32 25.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -137.13 114.27 9.83 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -169.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -70.23 164.62 80.11 Favored 'Cis proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.967 -1.68 . . . . 0.0 113.674 8.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -85.12 -24.26 2.14 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.588 1.526 . . . . 0.0 113.512 -169.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 85.9 p -66.59 -26.86 67.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.328 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -94.61 47.4 1.17 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.001 -0.68 . . . . 0.0 111.557 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -108.07 102.99 12.11 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.469 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 89.8 m-85 -79.61 161.03 26.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.3 -131.54 5.15 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 119.055 -1.545 . . . . 0.0 111.316 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -82.45 99.38 9.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 70.6 mtp -93.04 -112.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.131 -173.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.52 33.39 4.55 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.137 -0.977 . . . . 0.0 111.921 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 58.7 m -111.35 -83.24 0.58 Allowed 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.292 -178.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.7 ptp180 -158.38 -175.37 5.29 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 118.532 -1.267 . . . . 0.0 111.299 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -63.35 -48.7 76.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.947 -1.024 . . . . 0.0 113.016 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -97.44 23.68 7.37 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.435 -0.906 . . . . 0.0 113.113 -175.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -117.56 152.31 35.37 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.061 -1.024 . . . . 0.0 109.587 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -110.7 166.94 10.61 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.511 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 17.0 t -120.64 127.84 52.45 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 169.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 47.2 t -130.05 154.01 47.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.573 0.701 . . . . 0.0 109.617 -173.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.114 179.957 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt . . . . . 0 N--CA 1.469 0.477 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.08 -47.73 17.65 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.17 -0.956 . . . . 0.0 111.505 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.61 -36.8 70.91 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -173.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -76.71 -42.98 39.35 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.359 -0.838 . . . . 0.0 111.621 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -62.98 -43.45 98.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.048 -0.661 . . . . 0.0 112.445 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -68.7 -33.63 74.29 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.761 -0.776 . . . . 0.0 112.322 -178.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.62 92.89 1.22 Allowed Glycine 0 N--CA 1.465 0.599 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.82 170.84 31.28 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 119.233 -1.461 . . . . 0.0 111.662 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.26 144.01 38.21 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -79.7 132.98 36.34 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.976 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -140.13 157.08 69.78 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -51.36 142.61 37.14 Favored 'Trans proline' 0 CA--C 1.53 0.304 0 C-N-CA 121.507 1.472 . . . . 0.0 110.547 169.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.83 -14.35 61.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -92.76 -20.5 20.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -90.25 -106.49 0.09 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.112 -169.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.8 mt -115.81 132.51 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 122.758 1.266 . . . . 0.0 111.309 -173.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 t -132.99 123.59 26.16 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.265 -2.494 . . . . 0.0 104.265 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -118.35 117.13 34.96 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -76.52 165.24 85.73 Favored 'Cis proline' 0 CA--C 1.534 0.518 0 C-N-CA 123.131 -1.612 . . . . 0.0 111.815 6.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -49.36 -65.21 0.17 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.31 2.007 . . . . 0.0 116.058 -168.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.7 m -97.75 65.23 1.82 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.063 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.2 m -154.17 108.83 3.06 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.396 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -160.76 149.22 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.373 1.082 . . . . 0.0 111.798 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.428 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 99.0 m-85 -84.41 164.62 18.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.49 -140.98 2.21 Favored Glycine 0 N--CA 1.466 0.663 0 C-N-CA 119.552 -1.308 . . . . 0.0 111.806 -172.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -80.59 100.0 8.4 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 122.736 1.255 . . . . 0.0 108.357 176.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 93.7 mtp -90.2 -81.24 0.3 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.633 -172.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -148.06 57.84 1.09 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 119.548 -0.861 . . . . 0.0 110.713 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.3 m -135.13 -102.15 0.22 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.852 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -135.81 166.78 22.49 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.456 -0.777 . . . . 0.0 109.331 -172.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -57.51 -60.19 4.03 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -85.77 14.35 6.01 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.704 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.0 m0 -111.7 132.19 54.79 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.128 -0.983 . . . . 0.0 108.685 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -115.18 158.74 21.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.894 0.854 . . . . 0.0 110.431 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 44.7 t -91.83 115.21 27.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -78.77 148.3 33.03 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.804 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt . . . . . 0 N--CA 1.47 0.557 0 CA-C-O 121.383 0.611 . . . . 0.0 110.973 -171.363 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 tptt . . . . . 0 N--CA 1.468 0.433 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.6 -61.61 1.94 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.814 -0.754 . . . . 0.0 112.412 -172.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 72.4 m -78.59 -33.94 47.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.189 -1.004 . . . . 0.0 113.391 -174.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -72.31 -41.42 66.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.192 -0.943 . . . . 0.0 112.867 -173.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -65.55 -34.62 78.68 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.551 178.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -74.44 -47.86 31.06 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.455 173.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.11 69.17 0.18 Allowed Glycine 0 N--CA 1.465 0.593 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.991 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.47 -178.06 33.13 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 119.342 -1.408 . . . . 0.0 111.853 -177.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -155.51 158.93 39.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.9 m -78.81 120.27 23.2 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.338 -176.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 92.0 m-85 -120.02 152.3 54.0 Favored Pre-proline 0 N--CA 1.469 0.509 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 46.6 Cg_exo -69.52 153.29 70.21 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 121.37 1.38 . . . . 0.0 113.03 -175.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -68.89 -25.35 64.56 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.67 -26.46 66.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -91.54 137.26 32.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.748 0.785 . . . . 0.0 109.598 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.7 mt -85.93 124.78 40.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.778 -174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.1 t -93.77 138.46 31.93 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -125.46 122.87 24.99 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -171.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -81.0 165.99 75.23 Favored 'Cis proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.398 -1.501 . . . . 0.0 112.57 7.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.72 -12.39 15.03 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 121.723 1.615 . . . . 0.0 113.548 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.1 t -102.8 45.27 0.97 Allowed 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.452 -0.78 . . . . 0.0 111.512 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.0 p -160.55 63.73 0.32 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.862 0.839 . . . . 0.0 109.52 177.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -153.43 135.57 14.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.157 0.98 . . . . 0.0 109.114 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.717 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 82.7 m-85 -92.21 168.24 11.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.786 0.803 . . . . 0.0 109.4 179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.12 -116.05 2.68 Favored Glycine 0 N--CA 1.466 0.649 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.025 -174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -86.22 78.83 9.27 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.286 -0.965 . . . . 0.0 109.56 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.717 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.2 mtp -78.72 -85.28 0.08 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.8 p30 -120.94 40.52 3.53 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.045 0.926 . . . . 0.0 109.141 169.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 70.9 m -111.91 178.46 4.31 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.861 0.839 . . . . 0.0 110.557 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -95.35 -168.48 1.8 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.104 0.954 . . . . 0.0 111.24 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -55.69 -60.3 3.64 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -80.68 -6.01 57.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -111.38 163.54 13.89 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.853 -1.155 . . . . 0.0 110.509 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -147.64 166.67 26.71 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 57.8 m -94.0 120.25 33.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.059 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 t -97.02 142.76 28.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.955 174.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp . . . . . 0 C--N 1.327 -0.392 0 CA-C-O 121.546 0.689 . . . . 0.0 109.208 -179.309 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.5 tptm . . . . . 0 N--CA 1.464 0.258 0 CA-C-O 120.875 0.369 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -77.77 -51.47 10.48 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 119.848 -0.741 . . . . 0.0 112.016 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.7 t -58.87 -40.52 84.6 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -176.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -77.93 -39.04 44.08 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 119.503 -0.879 . . . . 0.0 112.444 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -72.56 -35.07 67.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.369 -0.832 . . . . 0.0 112.41 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -65.04 -42.96 93.84 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.51 -0.744 . . . . 0.0 111.499 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.84 76.53 0.15 Allowed Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.884 -1.151 . . . . 0.0 110.527 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -179.73 -179.16 48.76 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 118.897 -1.62 . . . . 0.0 112.125 -177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -136.43 144.23 44.33 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.7 t -79.72 132.86 36.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.27 1.033 . . . . 0.0 111.836 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.25 153.19 70.9 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -56.88 168.87 2.15 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 121.647 1.565 . . . . 0.0 112.905 175.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -80.28 -9.31 59.73 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.25 47.27 2.42 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.2 1.0 . . . . 0.0 111.915 -172.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -145.14 175.04 10.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.94 0.876 . . . . 0.0 110.255 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -90.74 122.85 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.734 0.778 . . . . 0.0 110.337 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.5 p -123.47 152.85 41.27 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.04 116.87 51.06 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -84.67 159.87 67.18 Favored 'Cis proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.297 -1.543 . . . . 0.0 112.05 9.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -82.73 -57.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 121.361 1.374 . . . . 0.0 112.781 -171.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m -92.98 58.69 3.01 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.374 -173.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 t -164.2 88.19 0.51 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.77 159.38 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.61 1.195 . . . . 0.0 111.875 -173.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.519 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 80.8 m-85 -97.71 179.22 4.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.497 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.07 -130.46 5.79 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 119.526 -1.321 . . . . 0.0 110.699 -176.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -81.93 109.08 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 118.954 -1.098 . . . . 0.0 108.787 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.595 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.3 mtp -107.45 -121.1 0.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.24 66.05 1.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.6 t -146.55 -142.25 0.13 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -83.41 160.6 21.56 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 120.943 -1.098 . . . . 0.0 109.997 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.3 t-105 -55.43 -38.1 68.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -110.45 14.15 22.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -104.89 151.85 23.35 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.036 -1.04 . . . . 0.0 109.867 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -110.3 165.81 11.47 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.067 0.937 . . . . 0.0 110.992 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.595 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 50.3 t -114.66 113.14 23.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -177.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 93.1 m -78.34 144.7 35.8 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.423 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 121.732 0.777 . . . . 0.0 110.337 -173.724 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt . . . . . 0 N--CA 1.467 0.379 0 CA-C-O 120.655 0.264 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -78.24 -50.74 11.31 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 119.696 -0.801 . . . . 0.0 112.411 -174.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.696 ' SG ' ' CB ' ' A' ' 28' ' ' MET . 86.5 m -62.96 -30.48 71.61 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.644 -0.822 . . . . 0.0 113.183 -177.604 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -72.13 -31.15 65.73 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.791 -0.764 . . . . 0.0 112.342 -179.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -71.55 -42.57 67.71 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.521 -0.737 . . . . 0.0 111.648 176.85 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.16 -44.9 59.31 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.447 -179.521 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.69 70.89 0.3 Allowed Glycine 0 N--CA 1.465 0.6 0 C-N-CA 120.031 -1.081 . . . . 0.0 110.406 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.32 159.32 30.35 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 119.627 -1.273 . . . . 0.0 110.534 -179.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -112.4 145.53 39.97 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 9.0 m -79.33 134.2 36.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.206 1.003 . . . . 0.0 110.873 179.335 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -142.5 154.57 63.58 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 176.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.07 161.51 2.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 121.648 1.565 . . . . 0.0 112.79 172.101 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -62.19 -29.48 70.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -178.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.58 -25.26 63.89 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.551 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -87.2 135.66 33.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.188 0.994 . . . . 0.0 110.728 -171.033 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -128.55 130.84 69.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.911 -176.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.432 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 29.2 p -91.91 101.85 14.42 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 170.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.42 HD12 ' HD3' ' A' ' 21' ' ' PRO . 14.7 tp -70.7 138.28 85.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.312 -172.361 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -85.04 168.08 52.62 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 123.647 -1.397 . . . . 0.0 112.618 8.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD3' HD12 ' A' ' 19' ' ' LEU . 56.7 Cg_endo -93.19 52.27 0.41 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 121.333 1.355 . . . . 0.0 111.649 -169.734 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.7 t -92.37 -59.4 2.09 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.981 -174.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -100.19 82.31 2.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.01 0.909 . . . . 0.0 109.386 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -109.82 103.79 12.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' HB2' ' A' ' 35' ' ' LYS . 52.5 m-85 -82.04 158.25 23.86 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.842 -0.743 . . . . 0.0 109.713 -177.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.3 -137.37 5.76 Favored Glycine 0 N--CA 1.468 0.792 0 C-N-CA 119.779 -1.201 . . . . 0.0 111.695 -174.393 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -76.01 104.89 6.76 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.355 1.074 . . . . 0.0 108.959 176.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.696 ' CB ' ' SG ' ' A' ' 4' ' ' CYS . 66.7 mmm -95.58 -76.36 0.5 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.844 -172.799 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -153.41 58.74 0.76 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.9 0.857 . . . . 0.0 110.1 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.5 m -141.45 -71.23 0.35 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.7 -175.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -151.26 165.55 33.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.866 0.841 . . . . 0.0 109.544 -177.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -60.48 -48.56 81.22 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -177.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -100.5 13.62 34.0 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.736 -0.785 . . . . 0.0 112.991 -177.574 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -108.27 165.81 11.22 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -146.73 174.9 11.04 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -175.558 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 99.1 m -110.29 123.74 50.37 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.612 176.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 45.1 t -104.96 149.67 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.117 0.961 . . . . 0.0 110.508 -177.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? . . . . . 0 C--N 1.325 -0.469 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -176.974 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.1 tptm . . . . . 0 N--CA 1.467 0.402 0 CA-C-O 121.131 0.491 . . . . 0.0 109.982 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -78.99 -50.56 10.91 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.838 -172.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.8 t -70.94 -32.88 69.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 119.087 -1.045 . . . . 0.0 112.629 -172.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -67.52 -36.31 80.78 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.079 178.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.55 -42.7 95.54 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.573 179.012 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -72.46 -45.63 58.63 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.325 177.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 124.11 77.79 0.35 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.594 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.58 174.31 38.94 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 119.262 -1.447 . . . . 0.0 111.91 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -141.25 154.56 45.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.165 0.983 . . . . 0.0 109.655 -178.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.6 t -79.09 123.89 27.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.936 0.874 . . . . 0.0 111.39 -175.622 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -136.45 159.27 71.26 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.145 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.66 149.02 51.42 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.788 1.659 . . . . 0.0 112.678 177.116 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -73.08 -52.04 15.8 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.927 -176.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.84 -26.28 68.26 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -176.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -77.06 147.03 36.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.972 0.891 . . . . 0.0 110.722 -178.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.3 mt -71.16 135.7 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 122.214 1.007 . . . . 0.0 110.938 -177.049 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.7 t -95.0 116.3 28.52 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 168.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -124.43 117.42 26.56 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -172.512 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.19 159.29 93.04 Favored 'Cis proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.298 -1.542 . . . . 0.0 111.949 6.086 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -94.58 55.63 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 121.532 1.488 . . . . 0.0 111.56 -169.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.3 p -67.94 -64.01 0.95 Allowed 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.767 -0.773 . . . . 0.0 112.305 -173.116 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.1 m -144.18 112.72 6.55 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 119.359 -0.937 . . . . 0.0 110.465 -179.364 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -98.35 118.36 34.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.08 0.943 . . . . 0.0 109.347 175.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.67 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 78.0 m-85 -92.3 165.85 12.89 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.606 178.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -77.91 -134.48 0.78 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 119.599 -1.286 . . . . 0.0 111.832 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -84.47 90.38 7.6 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.507 178.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.67 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 84.2 mtp -95.34 -115.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.459 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -91.36 75.52 6.03 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 171.348 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.7 t -148.2 168.21 23.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.074 -1.051 . . . . 0.0 110.986 -170.013 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' H ' ' A' ' 32' ' ' TRP . 70.0 ttt180 -73.6 178.07 4.96 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.537 0.684 . . . . 0.0 110.627 -175.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.471 ' H ' ' HG2' ' A' ' 31' ' ' ARG . 59.1 t-105 -55.79 -60.75 3.01 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.492 -0.755 . . . . 0.0 112.826 -172.14 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -95.44 24.03 5.48 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.6 -0.84 . . . . 0.0 112.432 178.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.3 m0 -112.28 163.46 14.36 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.138 -0.976 . . . . 0.0 110.024 -177.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -125.64 168.28 13.94 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.987 -178.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 t -106.79 133.09 51.98 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.326 176.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 49.7 t -120.49 145.3 47.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 122.178 0.99 . . . . 0.0 112.083 -173.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.999 173.581 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 69.0 mttm . . . . . 0 N--CA 1.469 0.485 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -72.06 -50.57 27.24 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.758 -177.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.5 t -77.18 -29.45 54.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.652 -0.819 . . . . 0.0 112.276 -176.48 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -68.16 -36.07 79.06 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.803 -0.759 . . . . 0.0 111.524 175.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -66.22 -42.66 88.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.478 177.06 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.97 -49.58 50.27 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.011 174.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.82 85.24 0.58 Allowed Glycine 0 N--CA 1.465 0.629 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.3 -176.52 39.87 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.541 -1.314 . . . . 0.0 111.314 -178.806 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -143.82 138.0 28.38 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.66 -0.816 . . . . 0.0 109.377 -178.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.5 m -80.14 135.01 36.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.451 1.12 . . . . 0.0 111.149 179.146 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -129.22 145.57 57.26 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.056 175.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -56.37 166.16 3.69 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.686 1.591 . . . . 0.0 113.208 177.389 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -59.41 -45.46 91.48 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.675 178.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.84 -27.15 69.13 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -175.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -86.97 134.49 33.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.132 0.967 . . . . 0.0 110.369 -172.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.4 mt -112.58 124.97 69.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.001 -171.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.4 p -94.33 137.06 33.93 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 168.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.83 120.58 55.23 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.584 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -86.02 159.01 57.77 Favored 'Cis proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.236 -1.568 . . . . 0.0 112.219 9.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.81 -27.04 4.18 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 121.743 1.629 . . . . 0.0 113.198 -173.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 95.7 p -85.28 59.57 5.71 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.478 -0.764 . . . . 0.0 110.763 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.7 m -162.44 80.73 0.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -158.59 147.33 18.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.124 0.964 . . . . 0.0 110.595 -175.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.49 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 84.4 m-85 -82.05 160.23 23.27 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.481 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -121.4 0.6 Allowed Glycine 0 N--CA 1.465 0.606 0 C-N-CA 119.244 -1.455 . . . . 0.0 110.754 -175.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -88.29 95.89 10.36 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.445 -0.902 . . . . 0.0 108.63 177.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.49 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.9 mtp -86.98 -108.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.53 50.61 0.8 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.96 0.886 . . . . 0.0 110.109 174.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.2 m -141.41 177.97 7.75 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -177.354 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -74.02 -178.85 3.48 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.272 1.034 . . . . 0.0 112.228 -171.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -57.17 -52.58 64.73 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -172.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -89.82 -3.26 58.22 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.566 -0.854 . . . . 0.0 113.104 -171.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -99.59 147.11 25.71 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.817 -1.177 . . . . 0.0 109.469 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -124.43 155.57 38.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -174.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.447 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 6.5 t -99.54 114.14 26.96 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.922 -1.111 . . . . 0.0 109.762 176.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.1 t -86.45 144.56 27.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.241 1.019 . . . . 0.0 111.171 -174.202 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.9 tptp . . . . . 0 C--N 1.326 -0.453 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.348 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttp . . . . . 0 N--CA 1.469 0.494 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -75.12 -49.26 20.15 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.195 -0.94 . . . . 0.0 112.771 -170.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 83.7 m -62.46 -32.79 73.72 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.294 -0.878 . . . . 0.0 112.206 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -71.88 -29.86 64.8 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.163 -0.615 . . . . 0.0 112.375 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -66.11 -43.3 87.6 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.59 -0.694 . . . . 0.0 111.732 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -72.9 -36.33 67.27 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 119.499 -0.88 . . . . 0.0 111.579 176.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.42 57.35 0.29 Allowed Glycine 0 N--CA 1.467 0.761 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.509 175.299 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -158.02 -170.59 22.94 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 119.632 -1.27 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -142.41 161.0 39.16 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.123 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 88.1 m -79.82 144.1 33.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.089 0.947 . . . . 0.0 111.087 175.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -135.26 145.55 54.45 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.036 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.2 153.91 55.72 Favored 'Trans proline' 0 C--N 1.332 -0.29 0 C-N-CA 121.556 1.504 . . . . 0.0 112.284 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -84.13 79.99 9.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.243 1.02 . . . . 0.0 110.205 -176.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -154.23 -35.84 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.773 178.495 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -93.24 156.2 16.97 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.887 0.851 . . . . 0.0 109.69 177.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.9 mt -87.13 130.65 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.096 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.2 t -86.8 131.31 34.16 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.676 173.127 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -122.96 119.81 27.75 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -173.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.84 161.06 83.2 Favored 'Cis proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.423 -1.49 . . . . 0.0 111.951 6.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -80.07 -7.96 14.22 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 121.69 1.594 . . . . 0.0 113.499 -176.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -71.51 -42.82 67.51 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.443 -0.786 . . . . 0.0 111.794 -178.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -88.56 65.75 7.94 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 122.309 1.052 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -118.41 120.1 36.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.584 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.8 m-85 -102.6 153.09 20.44 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.746 -0.782 . . . . 0.0 109.473 -175.51 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.98 -118.86 2.15 Favored Glycine 0 N--CA 1.466 0.639 0 C-N-CA 119.391 -1.385 . . . . 0.0 111.419 -171.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -83.37 81.54 8.67 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.178 178.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.584 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 86.6 mtp -83.37 -71.52 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.083 -179.716 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.449 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 35.3 t70 -126.9 31.48 5.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.571 0.701 . . . . 0.0 109.813 178.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 95.0 m -150.66 178.4 9.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 122.185 0.993 . . . . 0.0 110.86 -171.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -77.8 -175.44 3.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 122.253 1.025 . . . . 0.0 112.162 -171.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.1 t-105 -63.36 -51.43 65.93 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.379 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.39 6.52 11.96 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.888 -175.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 14.2 m0 -121.31 156.72 31.96 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -142.96 161.72 37.38 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.144 -177.44 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 43.2 m -102.02 153.88 19.48 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 119.651 -0.819 . . . . 0.0 110.054 174.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -149.82 156.7 42.26 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.933 -179.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt . . . . . 0 C--N 1.325 -0.47 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 173.905 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 N--CA 1.467 0.379 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -77.94 -49.67 13.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 119.499 -0.881 . . . . 0.0 112.011 -177.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.94 -36.99 75.7 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.997 -179.301 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -74.29 -37.98 63.51 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.012 178.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -67.77 -38.01 82.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.946 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -64.88 -37.3 87.16 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.615 176.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.42 66.85 0.68 Allowed Glycine 0 N--CA 1.466 0.681 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -178.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.97 170.74 30.72 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 119.503 -1.332 . . . . 0.0 111.48 -176.921 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -126.94 152.01 47.71 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 176.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.8 m -80.71 135.5 36.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.167 0.984 . . . . 0.0 111.418 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.9 m-85 -139.11 143.87 38.52 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.178 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.77 163.23 2.05 Favored 'Trans proline' 0 C--N 1.331 -0.361 0 C-N-CA 121.657 1.571 . . . . 0.0 112.213 171.051 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -85.12 45.9 1.22 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.713 -174.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -145.41 -29.02 0.44 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -173.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -87.44 172.82 9.52 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.273 1.035 . . . . 0.0 111.961 -171.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.48 139.97 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 122.381 1.086 . . . . 0.0 110.284 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -116.12 142.65 46.53 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 168.586 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.417 ' C ' HD13 ' A' ' 19' ' ' LEU . 1.9 tm? -135.41 114.76 11.5 Favored Pre-proline 0 C--N 1.325 -0.49 0 C-N-CA 119.301 -0.96 . . . . 0.0 108.61 -174.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.97 158.75 96.24 Favored 'Cis proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.375 -1.511 . . . . 0.0 111.699 2.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.92 -27.79 0.87 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.163 1.242 . . . . 0.0 114.444 -168.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.5 m -94.7 59.26 2.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.15 -0.969 . . . . 0.0 111.434 -172.086 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.4 m -166.18 69.16 0.12 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 175.478 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -128.45 130.27 47.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 122.171 0.986 . . . . 0.0 110.538 -176.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 23.5 m-85 -86.56 170.06 12.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.22 178.426 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.03 -137.84 6.34 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 119.54 -1.314 . . . . 0.0 111.202 -178.037 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -76.22 115.3 15.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.335 177.858 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.1 mtp -119.42 -95.95 0.48 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.72 -0.792 . . . . 0.0 109.051 -175.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.519 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 2.9 m-20 -107.79 53.71 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.33 179.602 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.519 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 58.2 m -152.2 -163.63 1.78 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.94 -178.88 5.73 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 120.932 -1.105 . . . . 0.0 111.681 -171.674 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -58.23 -51.78 68.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -171.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -95.56 7.55 45.92 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.614 -0.834 . . . . 0.0 113.191 -170.156 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -104.05 162.09 13.44 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.117 -0.989 . . . . 0.0 109.781 -178.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -132.66 167.3 20.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.971 -174.683 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.578 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 43.2 t -114.28 106.9 14.89 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.653 -174.093 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 t -92.65 148.4 22.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.161 -1.016 . . . . 0.0 111.801 -174.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--N 1.326 -0.434 0 CA-C-O 121.893 0.854 . . . . 0.0 109.098 178.942 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp . . . . . 0 N--CA 1.468 0.458 0 CA-C-O 120.949 0.404 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -77.46 -40.98 41.3 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.0 -176.172 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 10.5 t -73.1 -28.28 62.18 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.673 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -67.34 -28.78 68.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -174.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -54.88 -43.71 73.41 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 119.539 -0.865 . . . . 0.0 110.877 171.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -74.86 -48.99 22.09 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.723 173.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.28 84.5 1.18 Allowed Glycine 0 N--CA 1.467 0.729 0 C-N-CA 120.277 -0.963 . . . . 0.0 110.853 178.273 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.73 163.82 32.83 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 119.135 -1.507 . . . . 0.0 112.616 -176.68 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -120.83 154.93 35.11 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.651 0.739 . . . . 0.0 109.305 177.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.7 m -80.53 139.14 36.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.258 1.028 . . . . 0.0 111.574 -178.156 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -142.59 158.57 59.88 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 172.791 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.51 175.56 2.72 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 121.475 1.45 . . . . 0.0 113.395 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -93.39 75.46 4.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.614 0.721 . . . . 0.0 110.459 -176.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -169.29 -32.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.422 -177.436 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -85.47 172.18 11.2 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.55 1.167 . . . . 0.0 112.088 -173.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -87.74 134.01 28.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.816 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.65 105.25 17.36 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 171.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HA ' ' C ' ' A' ' 20' ' ' PRO . 23.9 tp -118.75 132.52 23.85 Favored Pre-proline 0 N--CA 1.469 0.48 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.173 -169.313 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.439 ' C ' ' HA ' ' A' ' 19' ' ' LEU . 62.2 Cg_exo -66.3 167.66 52.73 Favored 'Cis proline' 0 CA--C 1.532 0.411 0 CA-C-N 120.988 1.388 . . . . 0.0 114.0 4.427 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.81 75.16 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 121.444 1.429 . . . . 0.0 111.122 -169.076 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.2 p -140.05 -66.35 0.45 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.511 -177.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.9 m -99.39 81.95 2.6 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.713 0.768 . . . . 0.0 111.27 -172.474 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -106.61 118.08 35.74 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 172.505 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -95.7 153.74 17.57 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.7 -176.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.49 -122.77 1.97 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 119.667 -1.254 . . . . 0.0 111.363 -177.072 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -75.69 99.64 4.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 119.219 -0.992 . . . . 0.0 109.12 175.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 90.1 mmm -99.43 -120.39 0.15 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 176.201 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -103.62 40.77 1.37 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.089 -1.045 . . . . 0.0 110.714 170.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.9 m -93.97 -165.47 1.33 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 170.341 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -86.04 -171.21 3.46 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.752 -1.218 . . . . 0.0 109.918 176.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -59.47 -45.59 91.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -170.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -107.82 15.93 24.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -173.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -111.77 172.77 6.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.115 -0.991 . . . . 0.0 110.404 178.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -135.89 171.03 15.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.153 -0.619 . . . . 0.0 111.003 -174.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.3 t -113.71 143.42 44.64 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.787 -0.57 . . . . 0.0 109.94 177.164 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 19.5 t -125.26 143.2 51.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.851 0.834 . . . . 0.0 111.444 -175.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.1 tttt . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 173.252 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 47.4 p90 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 22.7 tptp -79.89 -55.21 5.14 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.169 -0.957 . . . . 0.0 111.736 -170.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -76.72 -47.85 20.61 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.502 -0.749 . . . . 0.0 112.082 178.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -64.03 -40.27 95.96 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -172.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.4 t-80 -66.95 -29.39 69.24 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -70.96 -48.78 51.44 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.763 -0.586 . . . . 0.0 112.549 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -72.88 -50.13 25.67 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.264 -0.898 . . . . 0.0 112.182 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 136.79 69.1 0.06 OUTLIER Glycine 0 N--CA 1.469 0.838 0 N-CA-C 109.86 -1.296 . . . . 0.0 109.86 -174.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.95 163.92 37.09 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.304 -176.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -137.49 144.03 42.02 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 92.9 m -78.77 133.57 37.09 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.151 0.977 . . . . 0.0 111.44 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -139.86 146.87 48.94 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 175.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.62 152.95 15.31 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 121.641 1.56 . . . . 0.0 112.527 171.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -23.61 60.98 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -89.45 -23.53 22.09 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -174.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -79.63 155.7 27.98 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 122.238 1.018 . . . . 0.0 111.583 -173.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -74.64 130.54 35.99 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-O 122.19 0.995 . . . . 0.0 112.049 -173.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.4 t -108.94 139.15 44.19 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 166.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.2 111.31 12.95 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 107.165 -1.42 . . . . 0.0 107.165 -177.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.67 159.38 96.71 Favored 'Cis proline' 0 CA--C 1.54 0.803 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.957 7.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -86.04 -38.11 0.1 OUTLIER 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 121.341 1.361 . . . . 0.0 114.904 -168.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 25.2 t -93.6 62.43 3.3 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.934 0.873 . . . . 0.0 111.859 -172.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.6 p -162.53 98.27 1.0 Allowed 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -150.39 141.86 23.42 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.781 1.277 . . . . 0.0 113.259 -170.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.496 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 62.5 m-85 -94.27 159.92 14.91 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 114.444 -1.253 . . . . 0.0 108.141 169.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.15 -124.95 2.52 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.378 -175.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.85 77.45 10.09 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.644 1.211 . . . . 0.0 110.281 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.653 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 96.4 mtp -73.42 -64.02 1.07 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.183 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.477 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 30.1 t70 -138.44 44.5 2.1 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.666 0.746 . . . . 0.0 109.367 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 86.5 m -153.35 -176.81 5.96 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.92 0.867 . . . . 0.0 110.76 -171.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -79.84 -177.68 6.06 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 122.245 1.021 . . . . 0.0 112.754 -170.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 t-105 -60.89 -56.86 16.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -173.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 -77.12 -4.41 44.33 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -175.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 40.7 m0 -108.58 153.01 23.98 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.166 -0.959 . . . . 0.0 109.334 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -140.19 153.56 46.65 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.641 -176.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 35.7 m -91.07 124.22 35.13 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.246 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.0 t -79.15 155.88 28.49 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.304 179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 29.4 ttpp -114.69 129.15 56.64 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.501 0.667 . . . . 0.0 110.895 -169.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -145.96 -63.54 0.32 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.042 173.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.92 0.94 Allowed Glycine 0 N--CA 1.469 0.873 0 C-N-CA 119.898 -1.144 . . . . 0.0 113.308 176.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.6 p -85.36 64.46 8.67 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 121.63 -0.924 . . . . 0.0 111.816 -179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 C-N-CA 120.279 -0.963 . . . . 0.0 111.898 173.819 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 83.1 t80 . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -75.75 -60.44 2.32 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.21 -0.931 . . . . 0.0 112.369 -172.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.408 ' OE1' ' SD ' ' A' ' 28' ' ' MET . 46.0 tt0 -76.67 -44.62 33.07 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.382 -0.824 . . . . 0.0 112.995 -174.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 79.7 m -66.15 -38.6 88.52 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.797 -176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -63.31 -31.12 72.18 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -62.96 -44.17 96.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.838 -0.539 . . . . 0.0 112.156 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -70.65 -45.88 64.31 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.495 -0.753 . . . . 0.0 111.737 172.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.77 83.93 0.9 Allowed Glycine 0 N--CA 1.468 0.781 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.06 -166.58 24.26 Favored Glycine 0 CA--C 1.526 0.777 0 C-N-CA 119.577 -1.296 . . . . 0.0 112.222 -175.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 44.0 t-80 -147.05 152.15 38.07 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.761 0.791 . . . . 0.0 108.986 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.1 m -79.8 123.99 28.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.054 -0.658 . . . . 0.0 110.177 175.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.414 ' CD1' ' HB3' ' A' ' 37' ' ' CYS . 96.9 m-85 -126.35 148.36 63.6 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 175.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -56.13 156.66 19.7 Favored 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 121.592 1.528 . . . . 0.0 112.08 171.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -62.4 -31.16 71.8 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -99.25 -23.1 15.31 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -170.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mttm -89.7 -161.22 0.76 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.529 -0.732 . . . . 0.0 111.75 -168.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.0 mt -79.1 139.19 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 122.707 1.242 . . . . 0.0 112.774 -169.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.2 t -116.02 144.48 44.05 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.805 -1.924 . . . . 0.0 105.805 166.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -141.65 110.58 6.23 Favored Pre-proline 0 N--CA 1.47 0.539 0 C-N-CA 119.461 -0.896 . . . . 0.0 108.866 -175.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.99 154.4 87.81 Favored 'Cis proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.531 -1.445 . . . . 0.0 111.622 0.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -77.68 -33.53 2.27 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 121.273 1.315 . . . . 0.0 115.123 -168.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.6 m -93.18 66.06 4.01 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.384 -0.823 . . . . 0.0 111.044 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.495 ' O ' ' SG ' ' A' ' 37' ' ' CYS . 55.4 m -163.74 74.64 0.33 Allowed 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 177.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 -101.33 141.85 33.59 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.548 1.166 . . . . 0.0 111.521 -172.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -117.59 152.45 35.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.538 -1.21 . . . . 0.0 108.031 175.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -76.03 -148.19 2.24 Favored Glycine 0 N--CA 1.47 0.967 0 C-N-CA 119.684 -1.246 . . . . 0.0 112.894 -173.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -81.11 95.29 6.82 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 122.815 1.293 . . . . 0.0 108.874 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.656 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 25.4 mmm -98.48 -74.52 0.58 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.844 -171.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -146.58 61.3 1.21 Allowed 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 177.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 74.0 m -129.97 -103.0 0.3 Allowed 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -177.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.2 ptm180 -149.27 -171.55 3.91 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.398 -0.814 . . . . 0.0 109.203 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.5 t-105 -60.16 -55.98 27.22 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -171.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -94.41 10.83 32.84 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.6 m0 -109.85 164.74 12.29 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 122.445 1.117 . . . . 0.0 110.082 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.3 pttt -130.21 159.39 37.0 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 115.089 -0.959 . . . . 0.0 110.17 -176.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 43.9 m -90.01 157.08 17.98 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 119.102 -1.039 . . . . 0.0 108.768 168.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.495 ' SG ' ' O ' ' A' ' 23' ' ' SER . 11.1 t -158.23 -178.83 7.58 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.894 0.854 . . . . 0.0 109.105 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -78.06 140.33 39.11 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.829 0.823 . . . . 0.0 110.227 -174.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.608 ' H ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -74.94 -47.49 29.36 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.62 1.341 . . . . 0.0 114.62 -170.184 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 119.35 65.29 0.29 Allowed Glycine 0 N--CA 1.47 0.933 0 C-N-CA 120.192 -1.004 . . . . 0.0 112.118 -177.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 92.7 p -161.61 -51.25 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 121.363 0.601 . . . . 0.0 109.77 175.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.198 0 N-CA-C 109.341 -1.504 . . . . 0.0 109.341 178.332 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 71.1 t80 . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.123 0.487 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -173.81 -71.92 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.112 -0.635 . . . . 0.0 109.46 169.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -79.0 -55.51 5.07 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 -173.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.719 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 77.8 m -62.98 -29.11 70.56 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -69.06 -29.55 67.7 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.303 -0.873 . . . . 0.0 112.494 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -58.7 -50.77 72.65 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.653 -0.655 . . . . 0.0 111.46 173.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -64.0 -47.11 81.59 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.303 172.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 103.61 55.84 0.78 Allowed Glycine 0 N--CA 1.468 0.791 0 C-N-CA 120.457 -0.878 . . . . 0.0 111.466 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.69 -152.29 7.69 Favored Glycine 0 N--CA 1.468 0.803 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -150.47 148.72 29.07 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.17 0.986 . . . . 0.0 109.992 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.5 t -80.92 113.81 19.38 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.785 0.802 . . . . 0.0 110.786 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -124.73 157.65 65.18 Favored Pre-proline 0 N--CA 1.471 0.579 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.556 178.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -58.77 157.88 26.5 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 121.849 1.7 . . . . 0.0 113.793 176.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -63.27 -27.85 69.62 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.91 -30.37 58.75 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.157 1.169 . . . . 0.0 114.157 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -74.48 154.48 38.69 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.228 1.013 . . . . 0.0 111.197 -171.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.0 mt -79.47 124.48 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 CA-C-O 122.022 0.915 . . . . 0.0 111.077 -169.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.418 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 49.4 t -95.49 140.51 30.24 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 169.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.21 119.31 29.67 Favored Pre-proline 0 N--CA 1.469 0.497 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.03 -172.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 166.77 82.06 Favored 'Cis proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.402 -1.499 . . . . 0.0 111.419 1.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -51.36 -49.81 15.95 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 122.098 1.865 . . . . 0.0 115.464 -172.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 73.9 p -92.58 56.73 2.77 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.638 0.732 . . . . 0.0 111.818 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.8 m -145.34 69.89 1.25 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 122.426 1.108 . . . . 0.0 109.574 172.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.418 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 5.1 p30 -144.27 151.42 39.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 122.083 0.944 . . . . 0.0 109.12 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.625 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 36.1 m-85 -98.04 170.2 9.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.608 0.718 . . . . 0.0 109.07 175.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.08 -142.82 3.47 Favored Glycine 0 N--CA 1.47 0.921 0 C-N-CA 119.673 -1.251 . . . . 0.0 112.441 -171.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -79.16 81.98 5.37 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 122.782 1.277 . . . . 0.0 109.57 176.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.719 ' HB2' ' SG ' ' A' ' 4' ' ' CYS . 95.1 mtp -82.17 -111.02 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 114.827 -1.078 . . . . 0.0 108.466 -178.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -91.24 64.13 5.14 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 170.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 8.3 t -142.64 169.71 17.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 -169.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 51.0 ttt85 -67.75 166.44 15.31 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.321 -0.862 . . . . 0.0 110.753 -177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -51.29 -46.84 62.62 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 93.8 mtt-85 -108.88 28.23 8.67 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 120.01 -0.676 . . . . 0.0 112.238 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.1 m0 -111.51 168.91 9.18 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 121.301 -0.874 . . . . 0.0 109.347 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -135.46 149.1 49.47 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.484 -176.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.7 m -89.48 114.91 26.48 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.803 0.811 . . . . 0.0 109.56 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 50.0 t -84.98 126.77 33.8 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.944 0.878 . . . . 0.0 109.693 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -161.08 129.89 4.58 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 -176.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -75.61 172.37 12.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 122.543 1.163 . . . . 0.0 111.827 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.75 -62.06 1.89 Allowed Glycine 0 CA--C 1.526 0.768 0 C-N-CA 119.979 -1.105 . . . . 0.0 110.44 171.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 97.9 p -90.78 73.04 6.64 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.129 0.966 . . . . 0.0 109.674 173.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.156 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 t80 . . . . . 0 N--CA 1.475 0.811 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt -123.08 167.5 13.58 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.412 1.101 . . . . 0.0 113.139 -168.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 64.2 tp60 -68.75 -52.22 32.88 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.175 -177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.0 t -68.21 -29.54 68.41 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.351 -178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -68.76 -30.14 68.68 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 120.376 -0.529 . . . . 0.0 111.908 174.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -67.01 -36.24 81.7 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -82.47 -53.32 6.08 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.004 174.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.64 81.83 0.14 Allowed Glycine 0 N--CA 1.467 0.708 0 C-N-CA 119.992 -1.099 . . . . 0.0 110.582 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.75 170.33 40.5 Favored Glycine 0 N--CA 1.468 0.773 0 C-N-CA 119.973 -1.108 . . . . 0.0 110.98 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -132.03 155.02 48.76 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.2 m -81.29 136.57 35.79 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 121.814 0.816 . . . . 0.0 112.282 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -134.1 149.63 72.02 Favored Pre-proline 0 N--CA 1.47 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.05 173.49 0.9 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 121.885 1.724 . . . . 0.0 114.019 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -77.25 -48.9 16.3 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.524 -0.735 . . . . 0.0 111.487 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -64.32 -29.88 70.95 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 114.866 1.432 . . . . 0.0 114.866 -175.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -86.42 137.52 32.49 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.34 -0.85 . . . . 0.0 109.727 -178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.4 mt -100.5 133.55 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 CA-C-O 121.795 0.807 . . . . 0.0 110.813 -170.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 28.3 p -102.39 149.51 24.29 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.4 tp -117.61 131.06 24.27 Favored Pre-proline 0 N--CA 1.47 0.559 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -174.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.7 160.54 90.67 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 CA-C-N 121.207 1.467 . . . . 0.0 113.363 5.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -85.19 -30.6 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.589 0 C-N-CA 121.254 1.303 . . . . 0.0 113.996 -169.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.5 m -93.45 52.62 1.76 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.312 -0.868 . . . . 0.0 110.771 178.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -150.23 77.88 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.65 0.738 . . . . 0.0 109.193 -178.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -157.95 158.9 35.85 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 122.311 1.053 . . . . 0.0 111.245 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.446 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 57.7 m-85 -99.66 170.04 8.85 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.342 -0.845 . . . . 0.0 109.645 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.09 -133.76 4.39 Favored Glycine 0 N--CA 1.47 0.902 0 C-N-CA 119.806 -1.188 . . . . 0.0 112.907 -170.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -84.92 86.88 7.33 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.16 0.981 . . . . 0.0 108.471 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.446 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 74.1 mtp -84.5 -76.26 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.894 -171.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -128.72 12.02 6.26 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 79.9 m -114.1 -157.78 0.64 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.62 -0.675 . . . . 0.0 109.578 178.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -78.88 -178.87 6.26 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.377 1.084 . . . . 0.0 111.92 -171.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.9 t-105 -63.51 -49.06 75.02 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -176.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -91.22 18.54 6.84 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 23.2 m0 -113.84 156.17 24.4 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 169.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -135.17 157.2 47.52 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.052 -0.659 . . . . 0.0 110.081 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.5 t -98.39 107.93 20.51 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.808 -176.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.0 t -97.33 148.64 22.93 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.284 1.04 . . . . 0.0 111.571 -172.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -141.56 137.57 32.06 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.909 176.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -94.28 -68.98 0.77 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.897 0.856 . . . . 0.0 110.367 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -177.32 -73.8 0.06 OUTLIER Glycine 0 N--CA 1.466 0.658 0 N-CA-C 107.555 -2.218 . . . . 0.0 107.555 -177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 59.4 m -85.16 59.84 5.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 108.68 168.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.149 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -172.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 55.1 t80 . . . . . 0 N--CA 1.475 0.783 0 N-CA-C 111.652 0.242 . . . . 0.0 111.652 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -84.19 -58.77 2.63 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 119.68 -0.808 . . . . 0.0 112.06 -169.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -77.19 -49.88 14.19 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.342 -173.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.6 t -77.36 -28.65 53.0 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 -172.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -70.77 -33.84 71.18 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.135 -0.978 . . . . 0.0 112.832 -175.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -76.91 -39.36 51.13 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.726 -0.609 . . . . 0.0 111.629 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -71.75 -35.63 70.17 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.498 -0.751 . . . . 0.0 112.299 177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.22 90.66 2.0 Favored Glycine 0 N--CA 1.47 0.934 0 C-N-CA 120.433 -0.889 . . . . 0.0 111.824 175.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.1 146.25 9.78 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 119.52 -1.324 . . . . 0.0 112.324 178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -101.57 143.8 31.11 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 175.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' SG ' ' HE3' ' A' ' 34' ' ' TRP . 42.3 t -85.54 131.32 34.39 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.361 -0.837 . . . . 0.0 111.864 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -132.73 154.08 81.32 Favored Pre-proline 0 N--CA 1.471 0.62 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -60.79 163.47 15.91 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.836 1.69 . . . . 0.0 111.599 169.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -68.67 -4.62 16.3 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.074 1.509 . . . . 0.0 115.074 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.33 -21.16 42.78 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.749 1.389 . . . . 0.0 114.749 -178.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -87.16 152.26 22.48 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.028 0.918 . . . . 0.0 112.57 -169.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -83.2 135.92 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 CA-C-O 121.822 0.82 . . . . 0.0 109.05 179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 26.5 t -96.09 119.16 34.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.726 0.774 . . . . 0.0 110.509 -179.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 18.7 tp -121.35 134.36 24.47 Favored Pre-proline 0 CA--C 1.541 0.619 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.88 168.33 76.85 Favored 'Cis proline' 0 CA--C 1.536 0.599 0 C-N-CA 123.676 -1.385 . . . . 0.0 111.72 2.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -58.53 -51.07 7.97 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.606 1.537 . . . . 0.0 114.777 -170.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 70.5 m -90.5 58.91 4.12 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.616 0.722 . . . . 0.0 111.468 -177.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.9 m -162.48 83.2 0.54 Allowed 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 122.14 0.971 . . . . 0.0 108.672 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -157.33 160.8 38.87 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.61 0.719 . . . . 0.0 109.104 -171.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.554 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.9 m-85 -135.54 163.96 28.9 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.816 0.817 . . . . 0.0 110.14 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.05 -143.31 5.65 Favored Glycine 0 N--CA 1.47 0.911 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.093 -176.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -77.68 98.4 5.46 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.317 1.055 . . . . 0.0 109.016 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.554 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 85.2 mtp -90.19 -113.63 0.07 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.584 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -110.62 68.64 0.67 Allowed 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.042 -1.095 . . . . 0.0 108.042 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.8 t -142.26 -88.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.7 ttt85 -141.47 155.37 45.84 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 72.5 t-105 -55.85 -34.15 65.17 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -174.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -109.49 15.34 23.04 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.458 0.91 . . . . 0.0 113.458 -178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.42 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 33.0 m0 -113.4 161.57 17.14 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.058 -1.026 . . . . 0.0 109.505 -178.171 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 43.9 mtmt -113.42 170.95 7.87 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.362 0.601 . . . . 0.0 110.364 177.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.9 t -119.92 97.15 5.47 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.443 -0.785 . . . . 0.0 109.174 173.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.41 ' SG ' ' HD2' ' A' ' 39' ' ' LYS . 43.3 t -86.12 150.54 24.35 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.768 0.794 . . . . 0.0 111.545 -176.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 ttmt -97.25 90.98 5.3 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.7 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HD2' ' SG ' ' A' ' 37' ' ' CYS . 20.8 ptmt -152.11 -145.36 0.17 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.248 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.54 -82.47 0.27 Allowed Glycine 0 N--CA 1.468 0.811 0 N-CA-C 110.928 -0.869 . . . . 0.0 110.928 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 72.2 m -136.29 98.11 3.76 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 -178.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.194 0 C-N-CA 119.357 -1.401 . . . . 0.0 112.37 179.806 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 87.3 t80 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -87.19 -78.26 0.31 Allowed 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.37 -0.832 . . . . 0.0 111.291 -171.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -77.38 -47.89 18.7 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.563 -0.71 . . . . 0.0 112.47 -174.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.7 t -62.99 -30.29 71.48 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -177.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.3 t-80 -76.96 -38.09 53.94 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.459 -0.776 . . . . 0.0 112.092 174.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -69.82 -42.48 73.6 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.593 -0.692 . . . . 0.0 112.504 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -71.69 -63.02 1.21 Allowed 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.316 -0.865 . . . . 0.0 111.235 177.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 146.84 83.7 0.05 OUTLIER Glycine 0 N--CA 1.467 0.723 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.627 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -168.19 163.76 37.43 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.664 -1.255 . . . . 0.0 111.242 -179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -123.78 147.28 47.68 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.6 m -78.47 125.28 29.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.755 0.788 . . . . 0.0 110.716 -178.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -132.98 156.56 79.95 Favored Pre-proline 0 N--CA 1.469 0.477 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 175.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.8 136.72 77.97 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 121.898 1.732 . . . . 0.0 112.294 175.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -76.87 -29.59 55.87 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.283 0.845 . . . . 0.0 113.283 -172.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -63.13 -28.26 69.94 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 172.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -81.52 144.76 31.09 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 122.096 0.95 . . . . 0.0 109.279 170.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.3 mt -87.71 133.92 29.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-O 121.864 0.84 . . . . 0.0 111.203 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 57.7 m -74.67 131.08 40.59 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 168.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.51 116.58 31.94 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 -177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.79 163.49 85.88 Favored 'Cis proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.482 -1.466 . . . . 0.0 112.56 7.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -72.01 -27.06 17.75 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 121.892 1.728 . . . . 0.0 113.834 -175.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 88.3 p -71.1 -28.92 64.66 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.51 -0.744 . . . . 0.0 112.804 175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.3 m -84.46 81.9 8.64 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 121.483 -0.761 . . . . 0.0 109.395 175.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -150.29 130.38 13.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 122.575 1.179 . . . . 0.0 111.058 -173.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.613 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 26.9 m-85 -106.4 152.24 23.86 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.327 173.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.56 -133.92 3.67 Favored Glycine 0 N--CA 1.471 0.976 0 C-N-CA 119.971 -1.109 . . . . 0.0 111.914 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -80.52 83.89 6.23 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 122.754 1.264 . . . . 0.0 110.213 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.613 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 94.1 mtp -81.17 -69.1 0.63 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.857 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -151.72 57.65 0.86 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 84.9 m -123.32 -105.36 0.36 Allowed 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -155.17 -169.21 3.1 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 121.349 -0.844 . . . . 0.0 109.114 172.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 45.7 t-105 -60.99 -51.76 67.88 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.31 -0.869 . . . . 0.0 112.987 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -85.58 -0.07 53.98 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -177.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.0 m0 -120.23 150.92 39.91 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.803 1.183 . . . . 0.0 109.767 -177.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -134.21 177.21 7.92 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.132 176.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -103.46 136.76 42.6 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.076 -1.015 . . . . 0.0 110.951 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 79.6 m -84.49 142.05 30.33 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -88.94 146.61 24.8 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.019 0.914 . . . . 0.0 110.391 -176.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -0.93 23.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.637 1.718 . . . . 0.0 115.637 -172.084 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 163.25 -112.12 0.5 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 119.538 -1.315 . . . . 0.0 110.954 177.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.0 t -75.52 -87.62 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 119.972 -0.691 . . . . 0.0 109.803 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.142 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.82 176.208 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 79.2 t80 . . . . . 0 N--CA 1.477 0.884 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -59.92 -56.38 22.47 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -78.49 -44.5 24.32 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.5 t -61.39 -40.75 95.49 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -71.32 -36.43 71.58 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.635 -0.666 . . . . 0.0 112.213 176.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -67.64 -38.04 83.29 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -177.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -72.39 -51.75 19.04 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.178 -0.952 . . . . 0.0 111.629 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.58 72.91 0.03 OUTLIER Glycine 0 N--CA 1.467 0.752 0 C-N-CA 119.99 -1.1 . . . . 0.0 111.113 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.52 -174.16 42.76 Favored Glycine 0 CA--C 1.527 0.797 0 C-N-CA 119.522 -1.323 . . . . 0.0 112.24 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -143.82 153.06 41.98 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.103 -0.702 . . . . 0.0 109.103 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.2 m -79.03 119.12 21.71 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.986 0.898 . . . . 0.0 110.773 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -126.89 152.38 75.24 Favored Pre-proline 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -60.03 168.93 5.3 Favored 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 121.49 1.46 . . . . 0.0 113.882 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -58.73 -51.39 70.17 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.668 -0.697 . . . . 0.0 112.373 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -63.0 -26.97 69.1 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -175.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -74.05 134.33 42.97 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 122.162 0.982 . . . . 0.0 109.969 176.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.1 mt -85.19 132.24 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.477 0 CA-C-O 121.821 0.82 . . . . 0.0 111.356 -169.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.444 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 94.0 m -78.23 136.52 37.8 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 169.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -120.8 117.93 30.84 Favored Pre-proline 0 N--CA 1.469 0.505 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.406 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 59.1 Cg_endo -80.32 166.24 76.48 Favored 'Cis proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.269 -1.555 . . . . 0.0 112.846 8.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 74.1 Cg_exo -59.35 -39.49 76.68 Favored 'Trans proline' 0 CA--C 1.534 0.512 0 C-N-CA 121.922 1.748 . . . . 0.0 115.102 -173.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 77.4 p -90.06 59.43 4.5 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.976 0.893 . . . . 0.0 110.823 176.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 45.3 t -161.27 85.75 0.67 Allowed 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.444 ' OD1' ' SG ' ' A' ' 18' ' ' CYS . 27.8 t70 -157.23 126.68 6.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.743 -0.783 . . . . 0.0 109.572 -169.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -83.12 154.03 24.53 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.77 -129.87 1.16 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 119.68 -1.248 . . . . 0.0 112.092 -174.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -84.23 94.97 8.53 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.784 0.802 . . . . 0.0 108.981 177.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 40.9 mmm -89.5 -77.52 0.38 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.994 -172.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -145.86 43.85 1.26 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.777 0.799 . . . . 0.0 111.454 -176.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 88.5 m -134.11 -151.21 0.43 Allowed 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 174.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -83.04 -178.61 7.18 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.622 -1.299 . . . . 0.0 111.567 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.1 t-105 -57.95 -54.09 50.91 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 -172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -92.98 25.26 3.28 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -114.16 154.89 27.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 122.394 1.092 . . . . 0.0 110.012 178.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -120.29 164.1 16.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.965 -177.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.6 t -110.85 112.19 23.87 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 169.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 55.9 m -78.62 143.8 36.06 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.238 -173.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp -114.12 142.98 45.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.353 -0.84 . . . . 0.0 108.929 174.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.458 ' H ' ' CD ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -76.52 178.81 6.35 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.898 0.856 . . . . 0.0 111.799 176.495 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -94.75 -116.88 2.92 Favored Glycine 0 N--CA 1.47 0.915 0 C-N-CA 120.103 -1.046 . . . . 0.0 112.573 -173.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 66.5 m -86.04 74.53 10.09 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.12 0.962 . . . . 0.0 110.708 -175.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 179.327 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 41.9 p90 . . . . . 0 N--CA 1.475 0.798 0 CA-C-O 122.345 1.069 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -132.32 -69.84 0.58 Allowed 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.591 -176.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -78.19 -49.48 13.71 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 21.3 t -68.0 -33.66 75.04 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 119.439 -0.904 . . . . 0.0 113.199 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -67.06 -30.51 70.59 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 120.028 -0.669 . . . . 0.0 112.751 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -66.4 -44.34 83.28 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.908 176.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.58 -50.43 11.54 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.748 -179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.25 92.27 0.44 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 120.022 -1.085 . . . . 0.0 110.85 178.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.99 172.13 42.11 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.954 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -130.87 143.31 50.64 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 m -78.16 128.56 33.97 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 122.343 1.068 . . . . 0.0 110.967 -179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -132.14 147.35 65.45 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 107.046 -1.465 . . . . 0.0 107.046 171.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.98 149.2 63.43 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 121.411 1.407 . . . . 0.0 112.213 175.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.93 -29.43 69.61 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -64.31 -25.06 67.88 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 176.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -79.06 150.48 31.86 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.481 -0.762 . . . . 0.0 110.374 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -78.42 113.42 17.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 CA-C-O 122.055 0.931 . . . . 0.0 110.643 -173.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.414 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 42.5 t -85.43 124.49 32.08 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 169.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -125.81 116.57 24.39 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -74.42 163.7 89.69 Favored 'Cis proline' 0 CA--C 1.535 0.571 0 C-N-CA 123.44 -1.483 . . . . 0.0 112.019 5.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -64.62 -29.82 60.65 Favored 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 121.97 1.78 . . . . 0.0 114.25 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 93.1 p -96.93 50.46 1.1 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.576 -0.703 . . . . 0.0 111.803 179.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 92.1 p -152.11 78.53 1.23 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 122.371 1.082 . . . . 0.0 109.626 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.4 p30 -156.84 158.14 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 122.192 0.996 . . . . 0.0 108.827 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.449 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 88.3 m-85 -91.53 174.01 7.59 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 170.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.92 -137.73 5.69 Favored Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.313 -1.422 . . . . 0.0 111.09 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -79.48 97.98 6.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.942 0.877 . . . . 0.0 108.874 177.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.449 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 61.2 mtp -89.34 -121.4 0.05 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.114 -172.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -95.54 48.51 1.15 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 121.369 -0.832 . . . . 0.0 110.808 176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 99.8 m -131.53 -93.39 0.39 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 -178.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.4 ptp180 -157.54 -176.1 5.76 Favored 'General case' 0 N--CA 1.473 0.712 0 O-C-N 120.824 -1.173 . . . . 0.0 112.482 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 29.8 t-105 -60.39 -55.46 33.25 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -175.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -90.55 23.36 3.05 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -175.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 34.9 m0 -119.93 142.75 48.45 Favored 'General case' 0 N--CA 1.471 0.624 0 O-C-N 121.099 -1.001 . . . . 0.0 109.474 177.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -113.88 157.96 21.68 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.575 -0.738 . . . . 0.0 109.683 173.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.402 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 4.3 t -100.51 107.13 18.75 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 119.233 -0.987 . . . . 0.0 108.955 174.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 46.4 t -81.5 142.81 32.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 122.143 0.973 . . . . 0.0 111.095 -172.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -131.2 95.44 3.79 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -82.45 163.93 21.3 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.542 1.163 . . . . 0.0 113.148 -171.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -107.01 -62.13 0.58 Allowed Glycine 0 CA--C 1.529 0.936 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.38 170.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.0 m -151.58 96.37 2.25 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.646 0.736 . . . . 0.0 109.563 175.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.153 0 C-N-CA 120.143 -1.027 . . . . 0.0 110.632 176.517 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 59.5 t80 . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.44 -80.32 0.33 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.777 -0.769 . . . . 0.0 110.454 -177.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -78.4 -51.65 9.73 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -171.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.6 t -65.97 -29.96 70.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -76.03 -32.46 59.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.489 -0.757 . . . . 0.0 112.567 175.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -68.39 -45.35 72.93 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.83 -0.544 . . . . 0.0 112.065 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -78.54 -28.44 46.1 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 121.638 -0.663 . . . . 0.0 112.579 176.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.99 60.83 0.71 Allowed Glycine 0 N--CA 1.468 0.822 0 C-N-CA 120.228 -0.987 . . . . 0.0 112.372 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.6 157.07 17.99 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -107.51 140.01 41.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 54.7 m -79.11 129.96 35.0 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.631 0.729 . . . . 0.0 111.096 -177.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -141.55 159.83 58.94 Favored Pre-proline 0 CA--C 1.538 0.502 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -63.32 144.14 90.66 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 121.736 1.624 . . . . 0.0 112.737 176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -73.9 -55.09 6.6 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 120.08 -0.648 . . . . 0.0 111.468 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.15 -30.51 70.43 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -176.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -92.67 169.66 10.33 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 122.14 0.971 . . . . 0.0 109.968 174.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.6 mt -74.67 124.67 32.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 121.518 -0.739 . . . . 0.0 111.187 -172.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -100.15 144.44 29.17 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 169.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -119.33 117.82 32.88 Favored Pre-proline 0 N--CA 1.469 0.514 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -173.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.72 162.65 74.78 Favored 'Cis proline' 0 CA--C 1.539 0.733 0 C-N-CA 123.736 -1.36 . . . . 0.0 112.641 9.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -88.34 -55.56 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.521 0 C-N-CA 121.128 1.219 . . . . 0.0 113.398 -169.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 97.3 p -85.6 48.9 1.66 Allowed 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.601 -0.687 . . . . 0.0 112.574 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 79.0 p -167.81 72.51 0.11 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -134.87 153.7 51.95 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 122.9 1.333 . . . . 0.0 112.513 -169.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.515 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 73.3 m-85 -94.7 164.31 13.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.938 173.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.29 -138.85 5.76 Favored Glycine 0 N--CA 1.468 0.832 0 C-N-CA 119.987 -1.101 . . . . 0.0 112.029 -175.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -82.22 90.09 6.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.962 0.887 . . . . 0.0 108.892 178.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.515 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 88.6 mtp -86.01 -86.37 0.14 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -175.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -140.72 50.6 1.66 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 122.052 0.93 . . . . 0.0 109.223 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 85.9 m -98.98 -90.92 0.29 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.162 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 43.9 ttt85 -150.21 -179.88 7.54 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.6 t-105 -57.99 -54.85 42.22 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 120.826 -1.171 . . . . 0.0 113.332 -174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -94.96 11.78 30.68 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -105.94 162.84 13.23 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 120.364 -1.46 . . . . 0.0 111.209 -174.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 61.2 pttt -144.12 171.87 13.68 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.003 -0.999 . . . . 0.0 110.164 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.435 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 1.3 m -104.1 145.93 29.47 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 121.099 -1.0 . . . . 0.0 110.587 -179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -130.47 155.68 46.05 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.475 -0.766 . . . . 0.0 109.999 173.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -142.29 143.39 32.79 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.3 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -113.6 -162.1 0.79 Allowed 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.331 0.586 . . . . 0.0 110.407 171.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -63.17 -67.59 2.01 Favored Glycine 0 N--CA 1.471 0.986 0 O-C-N 121.193 -0.942 . . . . 0.0 114.026 -174.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 t -90.72 69.1 6.57 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.737 0.78 . . . . 0.0 111.224 -176.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.139 0 CA-C-O 118.449 -1.195 . . . . 0.0 111.756 178.132 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 52.6 p90 . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -95.17 -71.73 0.66 Allowed 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.146 -0.971 . . . . 0.0 111.609 -174.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.31 -48.33 15.9 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -171.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.0 t -66.31 -39.65 89.46 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 -177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -70.54 -37.18 74.03 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -67.73 -43.6 79.58 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 121.444 -0.785 . . . . 0.0 112.585 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -69.99 -50.59 40.03 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.951 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 135.79 72.56 0.07 OUTLIER Glycine 0 N--CA 1.467 0.748 0 C-N-CA 120.045 -1.074 . . . . 0.0 110.933 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.98 152.52 17.48 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 119.533 -1.317 . . . . 0.0 111.484 -177.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -109.23 152.16 25.55 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.751 0.786 . . . . 0.0 109.577 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -79.87 126.18 30.66 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.17 0.986 . . . . 0.0 111.539 -178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -130.59 146.56 62.36 Favored Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 173.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.22 172.62 2.37 Favored 'Trans proline' 0 CA--C 1.535 0.572 0 C-N-CA 121.587 1.525 . . . . 0.0 113.106 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -68.2 -41.25 81.65 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 15' ' ' GLU . 1.6 pm0 -75.88 -25.49 56.17 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -70.24 138.9 52.06 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 122.084 0.945 . . . . 0.0 110.091 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.8 mt -78.82 120.98 30.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 CA-C-O 122.143 0.973 . . . . 0.0 110.642 -169.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 24' ' ' ASP . 43.5 t -85.65 126.3 33.82 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 169.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -121.27 116.5 30.94 Favored Pre-proline 0 N--CA 1.469 0.496 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 -172.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.46 162.44 90.51 Favored 'Cis proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.464 5.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -70.14 -32.05 17.73 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 121.929 1.752 . . . . 0.0 114.132 -172.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.4 m -91.63 60.2 3.96 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.791 -0.764 . . . . 0.0 110.017 175.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -165.99 71.01 0.14 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.968 0.89 . . . . 0.0 109.206 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.488 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 3.3 p30 -154.56 151.61 29.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.837 0.827 . . . . 0.0 108.968 178.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -93.02 174.19 7.36 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 119.601 -0.84 . . . . 0.0 108.901 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.24 -134.79 3.77 Favored Glycine 0 N--CA 1.47 0.916 0 C-N-CA 119.748 -1.215 . . . . 0.0 110.936 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.65 123.76 25.45 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 78.8 mmm -117.98 -95.39 0.48 Allowed 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 119.669 -0.813 . . . . 0.0 109.249 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -130.55 54.66 1.87 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 122.058 0.932 . . . . 0.0 109.852 178.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.6 m -144.85 -77.8 0.2 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.161 -0.615 . . . . 0.0 109.62 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -145.46 164.35 31.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.735 0.779 . . . . 0.0 109.539 -173.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 60.6 t-105 -61.62 -49.37 76.85 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -174.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -102.31 30.57 4.47 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -114.24 154.37 28.03 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 121.121 -0.987 . . . . 0.0 109.051 175.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -114.93 160.57 19.38 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.913 0.863 . . . . 0.0 111.58 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 42.0 t -107.72 103.78 13.14 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 175.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 44.4 t -79.66 148.61 31.55 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 122.211 1.005 . . . . 0.0 111.282 -172.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -84.11 111.86 19.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.787 0.803 . . . . 0.0 109.665 -175.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -118.5 -44.48 2.66 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.469 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 168.59 -97.3 0.13 Allowed Glycine 0 N--CA 1.466 0.646 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 44.3 t -152.68 79.25 1.21 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.69 0.757 . . . . 0.0 109.752 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.187 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.806 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 71.2 t80 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -91.65 -72.29 0.59 Allowed 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.289 -169.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -78.77 -50.19 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -175.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 52.8 t -62.85 -36.03 81.92 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 -177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -75.94 -32.69 59.67 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.652 -0.655 . . . . 0.0 112.693 178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -66.26 -42.36 88.64 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.73 -0.606 . . . . 0.0 112.072 177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -69.33 -48.35 61.67 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.579 -0.849 . . . . 0.0 110.66 171.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 119.72 92.88 1.41 Allowed Glycine 0 N--CA 1.463 0.471 0 N-CA-C 109.156 -1.578 . . . . 0.0 109.156 -179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -174.52 170.31 43.4 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 118.912 -1.613 . . . . 0.0 112.709 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.4 t60 -131.0 153.63 49.03 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 99.2 m -79.42 120.49 23.9 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 122.069 0.937 . . . . 0.0 110.992 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -116.81 154.28 49.44 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 171.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -60.97 172.55 2.91 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 121.393 1.395 . . . . 0.0 113.94 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -62.39 -44.78 95.63 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -63.84 -27.28 69.06 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -174.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -75.55 141.17 43.02 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.295 1.045 . . . . 0.0 111.26 -170.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.1 mt -81.51 133.46 29.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 121.948 0.88 . . . . 0.0 109.611 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 23' ' ' SER . 35.4 t -84.56 133.07 34.45 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -133.62 115.17 13.45 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 -176.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -74.47 164.33 88.23 Favored 'Cis proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.309 -1.538 . . . . 0.0 111.947 4.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.51 -13.95 20.21 Favored 'Trans proline' 0 CA--C 1.536 0.591 0 C-N-CA 121.767 1.644 . . . . 0.0 114.48 -171.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 48.2 m -71.22 -24.0 62.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 177.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.411 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 69.0 m -100.42 50.02 0.9 Allowed 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.673 -0.642 . . . . 0.0 111.574 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -101.94 100.13 10.39 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 175.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.55 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 24.8 m-85 -99.28 159.6 14.88 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.571 -174.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.15 -144.94 2.48 Favored Glycine 0 N--CA 1.471 0.97 0 C-N-CA 119.717 -1.23 . . . . 0.0 112.121 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -82.2 74.72 9.16 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-O 122.449 1.119 . . . . 0.0 110.577 178.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.55 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 95.6 mtp -71.18 -79.61 0.07 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.505 -179.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -111.05 52.95 0.72 Allowed 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 169.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.2 m -132.52 173.39 11.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.802 0.811 . . . . 0.0 109.946 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -79.96 -165.78 0.89 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 119.571 -0.851 . . . . 0.0 110.86 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.4 t-105 -52.48 -64.27 0.87 Allowed 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 -169.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -101.51 16.58 25.23 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -98.09 160.16 14.48 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.532 -1.355 . . . . 0.0 110.821 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -124.76 141.31 52.2 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.419 -0.81 . . . . 0.0 111.641 -169.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.35 122.42 30.29 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 171.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.9 t -128.35 144.58 51.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.618 0.723 . . . . 0.0 110.159 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -101.87 102.17 12.71 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 119.71 -0.796 . . . . 0.0 109.513 176.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.496 ' H ' ' HD3' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -81.51 -28.71 33.9 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 178.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -146.74 -102.78 0.32 Allowed Glycine 0 N--CA 1.467 0.744 0 N-CA-C 109.81 -1.316 . . . . 0.0 109.81 178.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.8 p -86.06 -45.46 11.39 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 119.861 -0.735 . . . . 0.0 111.425 176.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 N-CA-C 110.207 -1.157 . . . . 0.0 110.207 178.638 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 68.9 t80 . . . . . 0 N--CA 1.474 0.764 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -60.15 -55.66 31.11 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.504 -0.748 . . . . 0.0 112.351 -171.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.42 -46.99 18.51 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.066 -0.654 . . . . 0.0 111.995 176.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 9.1 t -72.14 -29.15 63.77 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -169.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -64.99 -29.14 70.04 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.274 -0.891 . . . . 0.0 112.49 178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -55.71 -45.26 77.93 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 120.432 -0.507 . . . . 0.0 111.937 173.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -76.88 -45.23 28.94 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.545 -0.722 . . . . 0.0 111.184 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.91 64.94 0.29 Allowed Glycine 0 N--CA 1.469 0.894 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.336 173.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.46 158.44 28.97 Favored Glycine 0 N--CA 1.467 0.761 0 C-N-CA 119.613 -1.279 . . . . 0.0 111.745 -179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -102.77 158.97 15.88 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.629 0.728 . . . . 0.0 109.759 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.0 m -79.34 138.58 37.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.106 0.955 . . . . 0.0 110.858 177.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -135.92 159.09 72.46 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -59.24 141.68 98.19 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 121.78 1.653 . . . . 0.0 113.237 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -72.06 -45.0 62.43 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.061 -0.655 . . . . 0.0 112.49 -177.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -59.35 -28.78 67.15 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -174.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -94.36 158.64 15.48 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.196 0.998 . . . . 0.0 110.349 -179.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.0 mt -83.89 132.67 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-O 121.817 0.817 . . . . 0.0 110.437 -172.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 41.9 t -89.34 137.57 32.21 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 169.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -115.44 118.57 39.35 Favored Pre-proline 0 CA--C 1.539 0.521 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 -176.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' A' ' 21' ' ' PRO . 72.0 Cg_endo -84.39 161.66 67.75 Favored 'Cis proline' 0 CA--C 1.537 0.636 0 C-N-CA 123.425 -1.489 . . . . 0.0 112.49 8.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 20' ' ' PRO . 47.1 Cg_exo -66.63 -39.46 15.76 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.617 1.545 . . . . 0.0 114.391 -177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 56.0 m -67.62 -36.92 81.74 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 -172.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.6 m -85.05 78.63 9.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.76 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -143.09 150.83 40.03 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.414 1.102 . . . . 0.0 110.187 -171.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.592 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 32.5 m-85 -125.95 154.94 42.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.35 -175.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.31 -138.69 4.55 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 119.785 -1.198 . . . . 0.0 112.285 -172.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -80.92 85.5 6.21 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 122.018 0.913 . . . . 0.0 109.098 176.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.592 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 82.7 mtp -84.88 -108.66 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 -177.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -108.23 66.8 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 171.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 90.2 m -129.06 -175.65 3.62 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.19 0.995 . . . . 0.0 111.015 -174.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -77.96 170.59 16.34 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.676 0.751 . . . . 0.0 110.669 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -53.53 -55.53 24.75 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -175.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.8 mtm105 -94.52 22.93 5.66 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.577 177.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 18.6 m0 -116.96 159.6 22.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 122.535 1.159 . . . . 0.0 109.353 178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -133.85 173.05 11.96 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.776 176.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.414 ' HB3' ' HB2' ' A' ' 25' ' ' PHE . 5.8 t -99.69 155.02 17.84 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.228 -0.989 . . . . 0.0 109.912 178.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -148.56 150.93 34.2 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.541 -0.864 . . . . 0.0 109.536 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -133.92 117.15 16.43 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.916 0.865 . . . . 0.0 110.089 -179.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -99.32 -72.58 0.66 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 176.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.64 78.15 0.3 Allowed Glycine 0 N--CA 1.468 0.785 0 N-CA-C 108.637 -1.785 . . . . 0.0 108.637 171.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 61.3 m 60.73 61.26 1.72 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.991 0.901 . . . . 0.0 110.79 -170.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -176.49 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 81.1 t80 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -82.87 -86.71 0.1 Allowed 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.355 -0.841 . . . . 0.0 111.011 -170.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 29.3 tp60 -76.15 -38.75 56.35 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 121.431 -0.793 . . . . 0.0 112.14 -179.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 29.4 t -55.41 -37.53 67.76 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -72.18 -39.09 68.93 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.723 -0.611 . . . . 0.0 112.279 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -66.27 -41.35 90.0 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.827 -0.546 . . . . 0.0 112.398 177.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -66.01 -38.55 88.74 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.423 -0.798 . . . . 0.0 111.656 172.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.16 83.84 1.7 Allowed Glycine 0 N--CA 1.467 0.734 0 C-N-CA 120.267 -0.968 . . . . 0.0 111.458 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.78 148.31 10.02 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 119.492 -1.337 . . . . 0.0 111.307 178.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -83.46 154.82 23.73 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.596 0.712 . . . . 0.0 109.183 175.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 37.2 m -78.76 125.3 29.18 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.724 -0.79 . . . . 0.0 110.133 177.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -128.98 148.34 68.56 Favored Pre-proline 0 N--CA 1.468 0.475 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.633 178.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -56.95 166.9 3.5 Favored 'Trans proline' 0 CA--C 1.536 0.618 0 C-N-CA 121.934 1.756 . . . . 0.0 113.55 173.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -61.67 -37.83 85.53 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -178.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -65.54 -20.13 66.21 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 115.214 1.561 . . . . 0.0 115.214 -176.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -75.69 124.46 27.28 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.381 -0.824 . . . . 0.0 111.106 -175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.3 mt -74.28 137.09 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 122.091 0.948 . . . . 0.0 109.638 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 33.5 t -88.56 123.95 33.55 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.978 179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 20.0 tp -134.11 125.24 17.91 Favored Pre-proline 0 CA--C 1.538 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_exo -70.46 167.14 73.97 Favored 'Cis proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.048 -1.647 . . . . 0.0 114.165 7.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -66.97 -30.13 39.84 Favored 'Trans proline' 0 CA--C 1.535 0.544 0 C-N-CA 121.702 1.601 . . . . 0.0 114.711 -171.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.6 m -69.35 -43.19 74.12 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -172.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.5 p -90.02 73.28 7.35 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.51 -0.744 . . . . 0.0 111.652 -174.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -123.19 132.66 54.14 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -117.85 148.56 42.0 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.37 0.605 . . . . 0.0 109.45 -175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.64 -124.74 2.04 Favored Glycine 0 N--CA 1.47 0.94 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.882 -175.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -78.97 113.12 16.83 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 175.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 92.3 mmm -117.91 -93.18 0.52 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -171.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -138.07 59.95 1.64 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.788 -1.189 . . . . 0.0 107.788 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 75.1 m -123.28 -88.93 0.61 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -179.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -159.54 -168.85 2.4 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 62.0 t-105 -61.95 -50.64 71.31 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -173.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -102.13 21.28 15.15 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -176.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -118.35 164.39 15.29 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 122.601 1.191 . . . . 0.0 110.304 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -132.81 178.8 6.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.702 -178.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.59 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 12.8 m -118.27 145.22 45.21 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.917 0.865 . . . . 0.0 109.752 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.421 ' SG ' ' HD2' ' A' ' 39' ' ' LYS . 42.8 t -141.89 141.36 33.02 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.904 0.859 . . . . 0.0 109.784 178.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -92.99 89.16 6.41 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.277 175.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.421 ' HD2' ' SG ' ' A' ' 37' ' ' CYS . 14.4 ptmm? -135.69 -56.07 0.78 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.114 -178.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.74 -121.51 0.99 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 119.648 -1.263 . . . . 0.0 111.265 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 96.0 p -91.9 -48.62 6.67 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.074 -0.65 . . . . 0.0 112.387 -175.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -178.37 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 58.0 t80 . . . . . 0 N--CA 1.474 0.768 0 CA-C-O 120.612 0.244 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -74.08 -57.0 4.26 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.193 -0.942 . . . . 0.0 111.361 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -76.93 -49.02 16.52 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 119.734 -0.786 . . . . 0.0 112.533 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.9 t -75.13 -31.02 60.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.344 -172.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.1 t-80 -68.88 -29.1 67.32 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.366 -0.834 . . . . 0.0 111.958 177.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -61.61 -39.86 92.76 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.05 -0.66 . . . . 0.0 111.494 177.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -75.13 -45.53 40.4 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.38 171.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 118.89 91.14 1.37 Allowed Glycine 0 N--CA 1.466 0.639 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.34 -176.24 39.14 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 118.845 -1.645 . . . . 0.0 112.91 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -138.91 145.29 39.68 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.7 m -90.86 143.8 26.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.642 1.21 . . . . 0.0 112.232 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -141.47 158.82 62.63 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.374 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -54.54 164.13 3.25 Favored 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.821 1.681 . . . . 0.0 113.493 175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -70.17 -22.57 62.95 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -80.57 -24.45 39.19 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -176.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -74.43 142.92 44.92 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.98 0.895 . . . . 0.0 110.821 -176.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.8 mt -82.0 131.81 32.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.92 0.867 . . . . 0.0 109.676 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 95.8 m -98.33 102.96 14.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 169.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.404 HD12 ' HD3' ' A' ' 21' ' ' PRO . 18.5 tp -110.38 133.61 21.05 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.26 163.31 86.11 Favored 'Cis proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.664 -1.39 . . . . 0.0 112.383 5.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HD3' HD12 ' A' ' 19' ' ' LEU . 50.8 Cg_endo -69.92 -24.33 29.07 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.645 1.563 . . . . 0.0 113.599 -171.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 89.4 p -87.62 49.44 1.81 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 122.056 0.932 . . . . 0.0 110.49 174.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.3 t -150.91 51.4 0.86 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' OD1' ' SG ' ' A' ' 37' ' ' CYS . 32.3 t70 -140.64 129.19 22.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.652 0.739 . . . . 0.0 109.291 -171.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -116.21 162.12 17.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -82.9 -145.56 5.9 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 119.231 -1.461 . . . . 0.0 111.546 -175.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.4 pttm -78.81 101.72 7.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 122.268 1.032 . . . . 0.0 108.952 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.409 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 90.9 mtp -96.92 -118.81 0.12 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 -174.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -96.81 62.77 1.93 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 122.0 0.905 . . . . 0.0 108.719 176.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 50.3 m -146.92 -160.97 1.23 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.519 0.676 . . . . 0.0 110.301 -174.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -71.21 157.17 38.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.185 0.993 . . . . 0.0 110.913 -174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -56.79 -50.22 72.99 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.17 0.804 . . . . 0.0 113.17 -174.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -95.68 12.1 31.02 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.858 -177.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.6 m0 -108.82 172.0 7.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.378 -0.826 . . . . 0.0 108.868 175.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.2 pttt -139.59 173.82 11.14 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.626 -0.829 . . . . 0.0 110.591 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.409 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 7.8 t -109.44 153.08 24.53 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.557 -177.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.435 ' SG ' ' OD1' ' A' ' 24' ' ' ASP . 89.2 m -139.43 157.79 45.25 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.342 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -80.69 80.31 7.17 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.997 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -127.5 166.41 18.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 122.329 1.061 . . . . 0.0 109.967 177.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -98.82 -62.77 0.85 Allowed Glycine 0 N--CA 1.466 0.692 0 N-CA-C 109.494 -1.442 . . . . 0.0 109.494 169.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.6 p -147.86 72.04 1.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.784 -0.766 . . . . 0.0 109.85 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 C-N-CA 119.479 -1.343 . . . . 0.0 111.094 178.116 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 15.0 p90 . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 121.817 0.818 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -156.07 -58.15 0.09 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 118.983 -1.087 . . . . 0.0 111.757 -172.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -74.11 -60.59 2.19 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.636 -0.826 . . . . 0.0 112.372 -170.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 4.6 t -78.37 -36.3 46.21 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.994 -1.066 . . . . 0.0 112.318 -179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 30.2 t-80 -65.82 -37.37 86.07 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.061 -0.656 . . . . 0.0 112.404 -174.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -78.96 -29.82 44.17 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.065 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -79.36 -59.68 2.66 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.258 -0.902 . . . . 0.0 110.254 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.09 90.6 0.15 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 119.724 -1.227 . . . . 0.0 111.245 176.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.69 -177.13 40.5 Favored Glycine 0 CA--C 1.527 0.812 0 C-N-CA 119.017 -1.563 . . . . 0.0 112.68 176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -138.17 150.35 46.7 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 98.1 m -82.1 136.95 35.11 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 122.117 0.96 . . . . 0.0 112.354 -176.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 96.0 m-85 -139.04 147.34 53.31 Favored Pre-proline 0 N--CA 1.467 0.398 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.9 148.21 48.01 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 121.729 1.619 . . . . 0.0 112.338 173.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.7 ttpt -70.48 -45.05 66.45 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 119.742 -0.783 . . . . 0.0 112.553 -174.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.19 -33.58 74.81 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -81.31 147.89 29.66 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.974 0.893 . . . . 0.0 109.835 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.3 mt -86.78 133.79 29.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.221 1.01 . . . . 0.0 111.303 -169.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.9 m -77.61 133.68 38.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.353 170.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -133.26 113.95 13.5 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -176.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -81.89 159.09 80.23 Favored 'Cis proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.184 -1.59 . . . . 0.0 112.627 10.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -93.9 48.52 0.31 Allowed 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 121.58 1.52 . . . . 0.0 111.123 -173.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 80.5 p -74.62 -41.35 60.56 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 119.956 -0.698 . . . . 0.0 112.172 -174.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.6 m -149.3 120.13 7.6 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.625 -0.83 . . . . 0.0 109.864 -173.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -114.85 104.51 12.02 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.89 0.852 . . . . 0.0 109.536 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.7 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 63.6 m-85 -79.2 162.94 25.4 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 122.065 0.936 . . . . 0.0 110.354 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.2 -126.99 5.27 Favored Glycine 0 N--CA 1.465 0.602 0 C-N-CA 119.64 -1.267 . . . . 0.0 111.741 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -82.12 96.82 7.91 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.673 -0.811 . . . . 0.0 109.004 -178.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.7 ' SD ' ' HB3' ' A' ' 25' ' ' PHE . 71.2 mtp -108.36 -116.01 0.28 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -177.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.437 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 60.8 m-20 -91.11 53.51 2.37 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.22 -0.925 . . . . 0.0 109.129 169.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 80.5 m -135.55 171.98 13.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.998 0.904 . . . . 0.0 110.78 -173.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 -64.56 166.14 9.0 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.654 0.74 . . . . 0.0 110.541 179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 64.5 t-105 -55.17 -51.96 64.85 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -174.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -96.03 24.29 5.69 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.463 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -111.23 -174.37 2.45 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 122.115 0.96 . . . . 0.0 108.811 174.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -150.2 166.99 28.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.24 -172.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.553 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 1.8 t -111.47 140.53 45.99 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.194 174.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.5 m -121.11 152.46 38.68 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 122.16 0.981 . . . . 0.0 110.588 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -148.86 131.5 15.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.31 -0.859 . . . . 0.0 108.831 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -80.05 172.82 13.27 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.589 174.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 118.15 -169.08 13.23 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 119.751 -1.214 . . . . 0.0 112.441 173.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 88.5 p -91.14 53.33 2.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.704 -0.748 . . . . 0.0 111.452 -176.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.112 0 C-N-CA 119.996 -1.097 . . . . 0.0 110.785 -179.467 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 89.8 t80 . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 120.382 0.134 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.0 tptm -99.41 -62.1 1.28 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 119.476 -0.89 . . . . 0.0 111.934 -170.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -77.56 -59.97 2.56 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 119.595 -0.842 . . . . 0.0 112.252 -170.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.447 ' H ' ' HB2' ' A' ' 29' ' ' ASP . 14.1 t -77.37 -30.75 53.92 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.221 -0.992 . . . . 0.0 112.968 -172.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.41 -34.87 78.67 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.594 -0.691 . . . . 0.0 111.891 178.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -70.25 -41.04 74.03 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.98 -0.688 . . . . 0.0 111.762 177.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -74.79 -57.86 3.65 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 119.675 -0.81 . . . . 0.0 110.992 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 143.53 84.67 0.07 OUTLIER Glycine 0 N--CA 1.465 0.595 0 C-N-CA 119.837 -1.173 . . . . 0.0 110.466 179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 178.67 169.21 39.06 Favored Glycine 0 CA--C 1.525 0.694 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.542 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -128.56 128.11 43.63 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 36' ' ' CYS . 48.7 t -80.81 136.15 36.07 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.321 1.058 . . . . 0.0 111.796 -175.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -138.51 158.41 70.51 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 114.81 -1.087 . . . . 0.0 108.202 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HA ' ' CG ' ' A' ' 34' ' ' TRP . 54.5 Cg_exo -61.72 178.46 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 121.442 1.428 . . . . 0.0 114.123 -179.177 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -61.8 -44.94 95.87 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.492 -0.777 . . . . 0.0 112.431 179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -63.55 -26.5 68.73 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -76.05 133.01 40.46 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.507 -173.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.1 mt -81.3 131.12 34.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.913 0.864 . . . . 0.0 110.051 -175.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -86.42 134.54 33.69 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 172.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -133.7 113.76 12.99 Favored Pre-proline 0 C--N 1.325 -0.491 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 -177.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -75.19 160.69 96.04 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 123.397 -1.501 . . . . 0.0 112.239 5.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.37 -26.66 10.14 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 121.837 1.692 . . . . 0.0 113.268 -174.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 84.6 p -71.23 -24.92 62.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 119.974 -0.69 . . . . 0.0 112.436 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 49.7 m -91.99 71.49 5.53 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.825 0.821 . . . . 0.0 109.851 178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -142.81 119.57 11.18 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 -177.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.52 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 71.6 m-85 -83.81 176.32 9.01 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.843 0.83 . . . . 0.0 109.796 177.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.39 -133.4 5.82 Favored Glycine 0 N--CA 1.466 0.664 0 C-N-CA 119.422 -1.371 . . . . 0.0 110.718 -177.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -76.4 117.34 17.96 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.416 -0.913 . . . . 0.0 108.877 176.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.52 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 82.9 mtp -122.44 -106.3 0.36 Allowed 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.625 -175.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.447 ' HB2' ' H ' ' A' ' 4' ' ' CYS . 15.5 t70 -95.4 50.67 1.26 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.545 -175.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.2 p -157.47 -89.2 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 119.85 -0.74 . . . . 0.0 109.323 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -159.64 -173.39 4.11 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.643 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 18.3 t-105 -54.94 -62.46 1.64 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -83.71 1.55 42.09 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.484 -0.886 . . . . 0.0 112.927 -170.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.401 ' CG ' ' HA ' ' A' ' 13' ' ' PRO . 34.5 m0 -97.11 150.05 21.28 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 121.231 -0.918 . . . . 0.0 109.157 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.38 159.46 24.16 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 120.08 -0.648 . . . . 0.0 109.977 -174.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.428 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 8.8 t -111.24 116.2 30.63 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 119.14 -1.024 . . . . 0.0 110.257 175.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.7 t -85.28 126.68 33.9 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.851 0.834 . . . . 0.0 110.209 -175.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -92.05 121.95 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.882 0.849 . . . . 0.0 109.028 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -154.86 -50.68 0.09 Allowed 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.075 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 151.89 -94.11 0.15 Allowed Glycine 0 N--CA 1.465 0.57 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -178.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.5 p -132.34 83.54 2.08 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.961 0.886 . . . . 0.0 110.131 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 C-N-CA 119.625 -1.274 . . . . 0.0 110.757 177.678 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 57.9 t80 . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.675 0.274 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -82.33 -68.84 0.67 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.441 -0.787 . . . . 0.0 109.827 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -77.35 -43.66 32.16 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.181 -0.608 . . . . 0.0 112.073 -177.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.47 ' SG ' ' SD ' ' A' ' 28' ' ' MET . 14.1 t -72.13 -29.1 63.73 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 119.237 -0.985 . . . . 0.0 113.553 -173.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -69.45 -31.67 70.13 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 119.329 -0.948 . . . . 0.0 111.404 176.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -66.15 -38.36 87.91 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.341 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -74.78 -49.18 21.77 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.271 175.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 123.89 80.31 0.46 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.488 -1.045 . . . . 0.0 110.488 -179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -176.69 169.58 42.07 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 119.023 -1.56 . . . . 0.0 112.757 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -118.99 150.22 40.31 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 41.6 m -80.46 137.42 36.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 122.198 0.999 . . . . 0.0 111.329 179.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -133.75 137.67 29.19 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -59.54 165.96 8.71 Favored 'Trans proline' 0 C--N 1.331 -0.39 0 C-N-CA 121.548 1.499 . . . . 0.0 112.344 175.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -77.77 86.07 4.05 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.98 0.895 . . . . 0.0 109.602 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -150.19 -27.74 0.24 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.263 -176.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -127.54 169.66 13.46 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 122.993 1.378 . . . . 0.0 112.533 -171.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.0 mt -77.95 137.17 22.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 114.212 -1.358 . . . . 0.0 110.25 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.3 t -86.54 117.32 25.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -137.13 114.27 9.83 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -169.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -70.23 164.62 80.11 Favored 'Cis proline' 0 CA--C 1.534 0.513 0 C-N-CA 122.967 -1.68 . . . . 0.0 113.674 8.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -85.12 -24.26 2.14 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 121.588 1.526 . . . . 0.0 113.512 -169.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 85.9 p -66.59 -26.86 67.31 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 119.716 -0.794 . . . . 0.0 112.328 177.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.1 p -94.61 47.4 1.17 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.001 -0.68 . . . . 0.0 111.557 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -108.07 102.99 12.11 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.469 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 89.8 m-85 -79.61 161.03 26.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.3 -131.54 5.15 Favored Glycine 0 N--CA 1.466 0.655 0 C-N-CA 119.055 -1.545 . . . . 0.0 111.316 -174.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -82.45 99.38 9.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.511 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 70.6 mtp -93.04 -112.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.131 -173.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.52 33.39 4.55 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 121.137 -0.977 . . . . 0.0 111.921 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 58.7 m -111.35 -83.24 0.58 Allowed 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.292 -178.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.7 ptp180 -158.38 -175.37 5.29 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 118.532 -1.267 . . . . 0.0 111.299 173.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 71.7 t-105 -63.35 -48.7 76.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.947 -1.024 . . . . 0.0 113.016 -172.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -97.44 23.68 7.37 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.435 -0.906 . . . . 0.0 113.113 -175.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 29.3 m0 -117.56 152.31 35.37 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.061 -1.024 . . . . 0.0 109.587 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -110.7 166.94 10.61 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 174.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.511 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 17.0 t -120.64 127.84 52.45 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 169.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.446 ' SG ' ' HG3' ' A' ' 39' ' ' LYS . 47.2 t -130.05 154.01 47.87 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.573 0.701 . . . . 0.0 109.617 -173.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -104.55 74.88 1.19 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.343 -0.943 . . . . 0.0 110.114 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.446 ' HG3' ' SG ' ' A' ' 37' ' ' CYS . 1.9 pptp? -160.46 170.31 21.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.027 0.918 . . . . 0.0 110.733 176.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -109.63 -83.19 1.43 Allowed Glycine 0 N--CA 1.467 0.724 0 C-N-CA 120.082 -1.056 . . . . 0.0 111.017 -179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 71.1 m -93.43 86.47 5.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.875 0.845 . . . . 0.0 110.055 -177.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 177.182 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 85.7 t80 . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 120.578 0.228 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.89 -38.34 64.41 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.429 -0.908 . . . . 0.0 113.298 -170.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -78.08 -47.73 17.65 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.17 -0.956 . . . . 0.0 111.505 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.61 -36.8 70.91 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -173.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 60.7 t-80 -76.71 -42.98 39.35 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.359 -0.838 . . . . 0.0 111.621 -178.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -62.98 -43.45 98.74 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.048 -0.661 . . . . 0.0 112.445 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -68.7 -33.63 74.29 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.761 -0.776 . . . . 0.0 112.322 -178.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 121.62 92.89 1.22 Allowed Glycine 0 N--CA 1.465 0.599 0 N-CA-C 109.282 -1.527 . . . . 0.0 109.282 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.82 170.84 31.28 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 119.233 -1.461 . . . . 0.0 111.662 -176.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 65.0 t-80 -139.26 144.01 38.21 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -79.7 132.98 36.34 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 119.497 -0.881 . . . . 0.0 110.976 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -140.13 157.08 69.78 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 176.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -51.36 142.61 37.14 Favored 'Trans proline' 0 CA--C 1.53 0.304 0 C-N-CA 121.507 1.472 . . . . 0.0 110.547 169.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -73.83 -14.35 61.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -92.76 -20.5 20.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -177.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -90.25 -106.49 0.09 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.112 -169.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.8 mt -115.81 132.51 65.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-O 122.758 1.266 . . . . 0.0 111.309 -173.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 35.6 t -132.99 123.59 26.16 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 104.265 -2.494 . . . . 0.0 104.265 167.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -118.35 117.13 34.96 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -172.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -76.52 165.24 85.73 Favored 'Cis proline' 0 CA--C 1.534 0.518 0 C-N-CA 123.131 -1.612 . . . . 0.0 111.815 6.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -49.36 -65.21 0.17 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.31 2.007 . . . . 0.0 116.058 -168.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 51.7 m -97.75 65.23 1.82 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.063 -175.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.2 m -154.17 108.83 3.06 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.107 -0.637 . . . . 0.0 109.396 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -160.76 149.22 16.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 122.373 1.082 . . . . 0.0 111.798 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.428 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 99.0 m-85 -84.41 164.62 18.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.49 -140.98 2.21 Favored Glycine 0 N--CA 1.466 0.663 0 C-N-CA 119.552 -1.308 . . . . 0.0 111.806 -172.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -80.59 100.0 8.4 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 122.736 1.255 . . . . 0.0 108.357 176.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 93.7 mtp -90.2 -81.24 0.3 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.633 -172.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 41.3 p-10 -148.06 57.84 1.09 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 119.548 -0.861 . . . . 0.0 110.713 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 53.3 m -135.13 -102.15 0.22 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.852 -178.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -135.81 166.78 22.49 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 121.456 -0.777 . . . . 0.0 109.331 -172.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.3 t-105 -57.51 -60.19 4.03 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.7 mtp-105 -85.77 14.35 6.01 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 119.588 -0.845 . . . . 0.0 112.704 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.0 m0 -111.7 132.19 54.79 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.128 -0.983 . . . . 0.0 108.685 -178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -115.18 158.74 21.83 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.894 0.854 . . . . 0.0 110.431 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 44.7 t -91.83 115.21 27.87 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -176.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 t -78.77 148.3 33.03 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.804 -171.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -96.08 151.28 19.61 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.383 0.611 . . . . 0.0 110.973 -171.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.25 -49.98 6.07 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.69 176.446 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 164.72 -69.37 0.2 Allowed Glycine 0 N--CA 1.466 0.696 0 C-N-CA 119.501 -1.333 . . . . 0.0 111.725 -177.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 90.4 p -81.67 80.85 7.91 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.99 0.9 . . . . 0.0 110.752 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.173 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 -178.251 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.406 ' O ' ' HB3' ' A' ' 5' ' ' HIS . 74.8 t80 . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 120.668 0.27 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 44.8 tptt -85.95 -37.38 19.1 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 119.034 -1.067 . . . . 0.0 111.985 -173.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -77.6 -61.61 1.94 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.814 -0.754 . . . . 0.0 112.412 -172.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 72.4 m -78.59 -33.94 47.18 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 119.189 -1.004 . . . . 0.0 113.391 -174.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 1' ' ' TYR . 48.4 t-80 -72.31 -41.42 66.58 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.192 -0.943 . . . . 0.0 112.867 -173.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -65.55 -34.62 78.68 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.551 178.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -74.44 -47.86 31.06 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.455 173.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 126.11 69.17 0.18 Allowed Glycine 0 N--CA 1.465 0.593 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.991 176.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.47 -178.06 33.13 Favored Glycine 0 CA--C 1.525 0.704 0 C-N-CA 119.342 -1.408 . . . . 0.0 111.853 -177.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -155.51 158.93 39.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.9 m -78.81 120.27 23.2 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.338 -176.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 13' ' ' PRO . 92.0 m-85 -120.02 152.3 54.0 Favored Pre-proline 0 N--CA 1.469 0.509 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 12' ' ' PHE . 46.6 Cg_exo -69.52 153.29 70.21 Favored 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 121.37 1.38 . . . . 0.0 113.03 -175.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -68.89 -25.35 64.56 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.67 -26.46 66.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -91.54 137.26 32.51 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.748 0.785 . . . . 0.0 109.598 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.7 mt -85.93 124.78 40.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.778 -174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.1 t -93.77 138.46 31.93 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -125.46 122.87 24.99 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 -171.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -81.0 165.99 75.23 Favored 'Cis proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.398 -1.501 . . . . 0.0 112.57 7.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -78.72 -12.39 15.03 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 121.723 1.615 . . . . 0.0 113.548 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 41.1 t -102.8 45.27 0.97 Allowed 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.452 -0.78 . . . . 0.0 111.512 -178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 89.0 p -160.55 63.73 0.32 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.862 0.839 . . . . 0.0 109.52 177.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -153.43 135.57 14.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.157 0.98 . . . . 0.0 109.114 -178.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.717 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 82.7 m-85 -92.21 168.24 11.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.786 0.803 . . . . 0.0 109.4 179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.12 -116.05 2.68 Favored Glycine 0 N--CA 1.466 0.649 0 C-N-CA 119.517 -1.325 . . . . 0.0 111.025 -174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -86.22 78.83 9.27 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 119.286 -0.965 . . . . 0.0 109.56 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.717 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.2 mtp -78.72 -85.28 0.08 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.8 p30 -120.94 40.52 3.53 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 122.045 0.926 . . . . 0.0 109.141 169.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 70.9 m -111.91 178.46 4.31 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.861 0.839 . . . . 0.0 110.557 -178.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -95.35 -168.48 1.8 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 122.104 0.954 . . . . 0.0 111.24 -177.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.8 t-105 -55.69 -60.3 3.64 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -80.68 -6.01 57.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 -176.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.4 m0 -111.38 163.54 13.89 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 120.853 -1.155 . . . . 0.0 110.509 -172.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -147.64 166.67 26.71 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.067 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.608 ' SG ' ' SG ' ' A' ' 30' ' ' CYS . 57.8 m -94.0 120.25 33.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.059 178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 14.2 t -97.02 142.76 28.58 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.955 174.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -113.38 103.96 11.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.546 0.689 . . . . 0.0 109.208 -179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.84 -26.35 29.57 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.67 75.5 0.05 OUTLIER Glycine 0 CA--C 1.525 0.683 0 C-N-CA 119.425 -1.369 . . . . 0.0 111.487 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 40.1 t -163.77 72.96 0.28 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.182 0 C-N-CA 119.704 -1.236 . . . . 0.0 110.286 -174.614 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 52.0 p90 . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 21.5 tptm -95.01 -66.41 0.91 Allowed 'General case' 0 C--N 1.324 -0.52 0 O-C-N 121.153 -0.967 . . . . 0.0 110.282 -172.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -77.77 -51.47 10.48 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 119.848 -0.741 . . . . 0.0 112.016 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 41.7 t -58.87 -40.52 84.6 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -176.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -77.93 -39.04 44.08 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 119.503 -0.879 . . . . 0.0 112.444 -179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -72.56 -35.07 67.91 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.369 -0.832 . . . . 0.0 112.41 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 39.2 mmtm -65.04 -42.96 93.84 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 121.51 -0.744 . . . . 0.0 111.499 177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 130.84 76.53 0.15 Allowed Glycine 0 N--CA 1.466 0.688 0 C-N-CA 119.884 -1.151 . . . . 0.0 110.527 178.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -179.73 -179.16 48.76 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 118.897 -1.62 . . . . 0.0 112.125 -177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -136.43 144.23 44.33 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.461 -0.941 . . . . 0.0 108.461 177.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.7 t -79.72 132.86 36.3 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 122.27 1.033 . . . . 0.0 111.836 -176.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.25 153.19 70.9 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -56.88 168.87 2.15 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 121.647 1.565 . . . . 0.0 112.905 175.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.6 pttp -80.28 -9.31 59.73 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -171.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -134.25 47.27 2.42 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.2 1.0 . . . . 0.0 111.915 -172.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -145.14 175.04 10.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.94 0.876 . . . . 0.0 110.255 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -90.74 122.85 42.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.734 0.778 . . . . 0.0 110.337 -175.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 22.5 p -123.47 152.85 41.27 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 167.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -111.04 116.87 51.06 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -84.67 159.87 67.18 Favored 'Cis proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.297 -1.543 . . . . 0.0 112.05 9.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -82.73 -57.63 0.03 OUTLIER 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 121.361 1.374 . . . . 0.0 112.781 -171.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 38.8 m -92.98 58.69 3.01 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.374 -173.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.0 t -164.2 88.19 0.51 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -149.77 159.38 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.61 1.195 . . . . 0.0 111.875 -173.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.519 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 80.8 m-85 -97.71 179.22 4.9 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.497 178.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -94.07 -130.46 5.79 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 119.526 -1.321 . . . . 0.0 110.699 -176.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -81.93 109.08 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 118.954 -1.098 . . . . 0.0 108.787 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.595 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.3 mtp -107.45 -121.1 0.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 -176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -100.24 66.05 1.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.6 t -146.55 -142.25 0.13 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -83.41 160.6 21.56 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 120.943 -1.098 . . . . 0.0 109.997 179.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.3 t-105 -55.43 -38.1 68.54 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -177.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -110.45 14.15 22.62 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 44.6 m0 -104.89 151.85 23.35 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.036 -1.04 . . . . 0.0 109.867 179.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.5 mtmp? -110.3 165.81 11.47 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 122.067 0.937 . . . . 0.0 110.992 -175.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.595 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 50.3 t -114.66 113.14 23.94 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -177.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 93.1 m -78.34 144.7 35.8 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.184 -1.006 . . . . 0.0 110.423 -177.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -90.54 120.94 32.05 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.732 0.777 . . . . 0.0 110.337 -173.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -130.81 -71.51 0.58 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.91 0.862 . . . . 0.0 109.715 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 135.23 63.04 0.06 OUTLIER Glycine 0 CA--C 1.526 0.72 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -171.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.2 t 66.23 88.71 0.11 Allowed 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.834 0.826 . . . . 0.0 111.362 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.25 0 C-N-CA 119.392 -1.385 . . . . 0.0 110.756 179.741 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 69.4 t80 . . . . . 0 N--CA 1.475 0.79 0 CA-C-O 120.737 0.303 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -90.47 -66.01 0.96 Allowed 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.456 -177.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -78.24 -50.74 11.31 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 119.696 -0.801 . . . . 0.0 112.411 -174.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.696 ' SG ' ' CB ' ' A' ' 28' ' ' MET . 86.5 m -62.96 -30.48 71.61 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.644 -0.822 . . . . 0.0 113.183 -177.604 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -72.13 -31.15 65.73 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 119.791 -0.764 . . . . 0.0 112.342 -179.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -71.55 -42.57 67.71 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.521 -0.737 . . . . 0.0 111.648 176.85 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.16 -44.9 59.31 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.447 -179.521 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 120.69 70.89 0.3 Allowed Glycine 0 N--CA 1.465 0.6 0 C-N-CA 120.031 -1.081 . . . . 0.0 110.406 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -159.32 159.32 30.35 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 119.627 -1.273 . . . . 0.0 110.534 -179.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -112.4 145.53 39.97 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 9.0 m -79.33 134.2 36.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.206 1.003 . . . . 0.0 110.873 179.335 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -142.5 154.57 63.58 Favored Pre-proline 0 C--N 1.325 -0.499 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 176.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -52.07 161.51 2.43 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 121.648 1.565 . . . . 0.0 112.79 172.101 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 pttp -62.19 -29.48 70.4 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -178.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.58 -25.26 63.89 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 179.551 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -87.2 135.66 33.22 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.188 0.994 . . . . 0.0 110.728 -171.033 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.3 mt -128.55 130.84 69.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.911 -176.894 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.432 ' O ' ' SG ' ' A' ' 18' ' ' CYS . 29.2 p -91.91 101.85 14.42 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 170.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.42 HD12 ' HD3' ' A' ' 21' ' ' PRO . 14.7 tp -70.7 138.28 85.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.312 -172.361 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -85.04 168.08 52.62 Favored 'Cis proline' 0 CA--C 1.534 0.484 0 C-N-CA 123.647 -1.397 . . . . 0.0 112.618 8.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.42 ' HD3' HD12 ' A' ' 19' ' ' LEU . 56.7 Cg_endo -93.19 52.27 0.41 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 121.333 1.355 . . . . 0.0 111.649 -169.734 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 37.7 t -92.37 -59.4 2.09 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 110.981 -174.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -100.19 82.31 2.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.01 0.909 . . . . 0.0 109.386 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -109.82 103.79 12.65 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.422 ' O ' ' HB2' ' A' ' 35' ' ' LYS . 52.5 m-85 -82.04 158.25 23.86 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.842 -0.743 . . . . 0.0 109.713 -177.868 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.3 -137.37 5.76 Favored Glycine 0 N--CA 1.468 0.792 0 C-N-CA 119.779 -1.201 . . . . 0.0 111.695 -174.393 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -76.01 104.89 6.76 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.355 1.074 . . . . 0.0 108.959 176.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.696 ' CB ' ' SG ' ' A' ' 4' ' ' CYS . 66.7 mmm -95.58 -76.36 0.5 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.844 -172.799 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -153.41 58.74 0.76 Allowed 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.9 0.857 . . . . 0.0 110.1 177.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.5 m -141.45 -71.23 0.35 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.7 -175.556 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 55.6 ttt85 -151.26 165.55 33.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.866 0.841 . . . . 0.0 109.544 -177.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.9 t-105 -60.48 -48.56 81.22 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -177.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -100.5 13.62 34.0 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 119.736 -0.785 . . . . 0.0 112.991 -177.574 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 38.2 m0 -108.27 165.81 11.22 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 121.228 -0.92 . . . . 0.0 109.492 176.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -146.73 174.9 11.04 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.954 -175.558 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 99.1 m -110.29 123.74 50.37 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.612 176.707 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 45.1 t -104.96 149.67 25.55 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 122.117 0.961 . . . . 0.0 110.508 -177.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -149.15 130.45 14.65 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -176.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -74.98 -135.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.989 -0.685 . . . . 0.0 110.71 -175.033 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -179.67 -73.73 0.06 OUTLIER Glycine 0 CA--C 1.525 0.656 0 C-N-CA 119.498 -1.334 . . . . 0.0 111.274 -176.142 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -82.47 -62.29 1.65 Allowed 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.158 -176.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.483 -1.176 . . . . 0.0 110.818 -178.76 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 64.2 t80 . . . . . 0 N--CA 1.472 0.654 0 CA-C-O 121.267 0.556 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -174.27 -69.76 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.982 170.044 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -78.99 -50.56 10.91 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.838 -172.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 11.8 t -70.94 -32.88 69.91 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 119.087 -1.045 . . . . 0.0 112.629 -172.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -67.52 -36.31 80.78 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.079 178.691 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.55 -42.7 95.54 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.573 179.012 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -72.46 -45.63 58.63 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 119.718 -0.793 . . . . 0.0 111.325 177.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 124.11 77.79 0.35 Allowed Glycine 0 N--CA 1.466 0.671 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.594 179.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.58 174.31 38.94 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 119.262 -1.447 . . . . 0.0 111.91 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -141.25 154.56 45.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 122.165 0.983 . . . . 0.0 109.655 -178.601 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.6 t -79.09 123.89 27.78 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.936 0.874 . . . . 0.0 111.39 -175.622 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -136.45 159.27 71.26 Favored Pre-proline 0 N--CA 1.469 0.499 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.145 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -55.66 149.02 51.42 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.788 1.659 . . . . 0.0 112.678 177.116 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -73.08 -52.04 15.8 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.686 -0.806 . . . . 0.0 111.927 -176.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.84 -26.28 68.26 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.051 1.13 . . . . 0.0 114.051 -176.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -77.06 147.03 36.93 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.972 0.891 . . . . 0.0 110.722 -178.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 91.3 mt -71.16 135.7 27.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 CA-C-O 122.214 1.007 . . . . 0.0 110.938 -177.049 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 53.7 t -95.0 116.3 28.52 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 168.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -124.43 117.42 26.56 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -172.512 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -78.19 159.29 93.04 Favored 'Cis proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.298 -1.542 . . . . 0.0 111.949 6.086 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -94.58 55.63 0.27 Allowed 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 121.532 1.488 . . . . 0.0 111.56 -169.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 82.3 p -67.94 -64.01 0.95 Allowed 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 119.767 -0.773 . . . . 0.0 112.305 -173.116 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 68.1 m -144.18 112.72 6.55 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 119.359 -0.937 . . . . 0.0 110.465 -179.364 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -98.35 118.36 34.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 122.08 0.943 . . . . 0.0 109.347 175.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.67 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 78.0 m-85 -92.3 165.85 12.89 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.606 178.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -77.91 -134.48 0.78 Allowed Glycine 0 CA--C 1.525 0.705 0 C-N-CA 119.599 -1.286 . . . . 0.0 111.832 -177.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -84.47 90.38 7.6 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.507 178.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.67 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 84.2 mtp -95.34 -115.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.459 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -91.36 75.52 6.03 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 171.348 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 4.7 t -148.2 168.21 23.08 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.074 -1.051 . . . . 0.0 110.986 -170.013 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' H ' ' A' ' 32' ' ' TRP . 70.0 ttt180 -73.6 178.07 4.96 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.537 0.684 . . . . 0.0 110.627 -175.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.471 ' H ' ' HG2' ' A' ' 31' ' ' ARG . 59.1 t-105 -55.79 -60.75 3.01 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 121.492 -0.755 . . . . 0.0 112.826 -172.14 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -95.44 24.03 5.48 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.6 -0.84 . . . . 0.0 112.432 178.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.3 m0 -112.28 163.46 14.36 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.138 -0.976 . . . . 0.0 110.024 -177.414 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -125.64 168.28 13.94 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.987 -178.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 t -106.79 133.09 51.98 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 119.084 -1.046 . . . . 0.0 109.326 176.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 49.7 t -120.49 145.3 47.41 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 122.178 0.99 . . . . 0.0 112.083 -173.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -96.09 152.76 18.24 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.114 -0.948 . . . . 0.0 108.999 173.581 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.464 ' H ' ' CD ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -85.64 -175.99 5.87 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.453 -0.899 . . . . 0.0 110.48 176.445 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -103.36 -113.83 3.86 Favored Glycine 0 N--CA 1.466 0.673 0 C-N-CA 119.579 -1.296 . . . . 0.0 111.956 -172.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.2 p -91.22 79.15 5.73 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 122.087 0.946 . . . . 0.0 110.119 -175.793 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.064 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.913 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 31.2 p90 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 122.1 0.952 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -135.16 -70.16 0.49 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.777 -178.675 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -72.06 -50.57 27.24 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.758 -177.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 8.5 t -77.18 -29.45 54.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.652 -0.819 . . . . 0.0 112.276 -176.48 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -68.16 -36.07 79.06 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 119.803 -0.759 . . . . 0.0 111.524 175.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 ttpp -66.22 -42.66 88.42 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.478 177.06 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -69.97 -49.58 50.27 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 119.544 -0.863 . . . . 0.0 111.011 174.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 125.82 85.24 0.58 Allowed Glycine 0 N--CA 1.465 0.629 0 N-CA-C 110.041 -1.224 . . . . 0.0 110.041 -179.528 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.3 -176.52 39.87 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 119.541 -1.314 . . . . 0.0 111.314 -178.806 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -143.82 138.0 28.38 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.66 -0.816 . . . . 0.0 109.377 -178.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 64.5 m -80.14 135.01 36.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 122.451 1.12 . . . . 0.0 111.149 179.146 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -129.22 145.57 57.26 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.056 175.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_exo -56.37 166.16 3.69 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 121.686 1.591 . . . . 0.0 113.208 177.389 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -59.41 -45.46 91.48 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 119.719 -0.793 . . . . 0.0 111.675 178.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -62.84 -27.15 69.13 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -175.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -86.97 134.49 33.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.132 0.967 . . . . 0.0 110.369 -172.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 97.4 mt -112.58 124.97 69.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.001 -171.659 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 23.4 p -94.33 137.06 33.93 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 168.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -100.83 120.58 55.23 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 -174.584 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -86.02 159.01 57.77 Favored 'Cis proline' 0 CA--C 1.531 0.371 0 C-N-CA 123.236 -1.568 . . . . 0.0 112.219 9.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -79.81 -27.04 4.18 Favored 'Trans proline' 0 CA--C 1.532 0.407 0 C-N-CA 121.743 1.629 . . . . 0.0 113.198 -173.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 95.7 p -85.28 59.57 5.71 Favored 'General case' 0 N--CA 1.467 0.411 0 O-C-N 121.478 -0.764 . . . . 0.0 110.763 -179.462 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.7 m -162.44 80.73 0.52 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.399 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -158.59 147.33 18.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.124 0.964 . . . . 0.0 110.595 -175.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.49 ' HB2' ' SD ' ' A' ' 28' ' ' MET . 84.4 m-85 -82.05 160.23 23.27 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 170.481 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -81.88 -121.4 0.6 Allowed Glycine 0 N--CA 1.465 0.606 0 C-N-CA 119.244 -1.455 . . . . 0.0 110.754 -175.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.9 mtmm -88.29 95.89 10.36 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 119.445 -0.902 . . . . 0.0 108.63 177.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.49 ' SD ' ' HB2' ' A' ' 25' ' ' PHE . 90.9 mtp -86.98 -108.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 179.699 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -103.53 50.61 0.8 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.96 0.886 . . . . 0.0 110.109 174.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 92.2 m -141.41 177.97 7.75 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 -177.354 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 18.8 ptp180 -74.02 -178.85 3.48 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 122.272 1.034 . . . . 0.0 112.228 -171.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 75.9 t-105 -57.17 -52.58 64.73 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 -172.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 94.6 mtt-85 -89.82 -3.26 58.22 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.566 -0.854 . . . . 0.0 113.104 -171.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -99.59 147.11 25.71 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.817 -1.177 . . . . 0.0 109.469 -178.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt -124.43 155.57 38.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 -174.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.447 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 6.5 t -99.54 114.14 26.96 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.922 -1.111 . . . . 0.0 109.762 176.881 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 42.1 t -86.45 144.56 27.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.241 1.019 . . . . 0.0 111.171 -174.202 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -156.85 119.59 4.03 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -178.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -80.63 171.45 15.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 122.539 1.161 . . . . 0.0 112.333 -175.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -94.79 -64.68 1.0 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 169.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 41.8 t -154.58 96.15 1.86 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.893 -0.723 . . . . 0.0 109.181 177.117 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 C-N-CA 119.671 -1.252 . . . . 0.0 110.736 179.58 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 73.3 t80 . . . . . 0 N--CA 1.472 0.658 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttp -142.21 -137.68 0.11 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 119.704 -0.799 . . . . 0.0 109.247 178.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -75.12 -49.26 20.15 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.195 -0.94 . . . . 0.0 112.771 -170.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 28' ' ' MET . 83.7 m -62.46 -32.79 73.72 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.294 -0.878 . . . . 0.0 112.206 -179.87 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -71.88 -29.86 64.8 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.163 -0.615 . . . . 0.0 112.375 -179.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -66.11 -43.3 87.6 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.59 -0.694 . . . . 0.0 111.732 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -72.9 -36.33 67.27 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 119.499 -0.88 . . . . 0.0 111.579 176.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.42 57.35 0.29 Allowed Glycine 0 N--CA 1.467 0.761 0 C-N-CA 120.055 -1.069 . . . . 0.0 111.509 175.299 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -158.02 -170.59 22.94 Favored Glycine 0 CA--C 1.525 0.675 0 C-N-CA 119.632 -1.27 . . . . 0.0 110.885 -179.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -142.41 161.0 39.16 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.917 -0.713 . . . . 0.0 109.123 -177.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 88.1 m -79.82 144.1 33.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.089 0.947 . . . . 0.0 111.087 175.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -135.26 145.55 54.45 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 175.036 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -60.2 153.91 55.72 Favored 'Trans proline' 0 C--N 1.332 -0.29 0 C-N-CA 121.556 1.504 . . . . 0.0 112.284 -179.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -84.13 79.99 9.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.243 1.02 . . . . 0.0 110.205 -176.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -154.23 -35.84 0.1 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.773 178.495 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm -93.24 156.2 16.97 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.887 0.851 . . . . 0.0 109.69 177.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.9 mt -87.13 130.65 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 119.731 -0.788 . . . . 0.0 109.096 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.2 t -86.8 131.31 34.16 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.676 173.127 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -122.96 119.81 27.75 Favored Pre-proline 0 C--N 1.325 -0.474 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -173.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -80.84 161.06 83.2 Favored 'Cis proline' 0 CA--C 1.533 0.444 0 C-N-CA 123.423 -1.49 . . . . 0.0 111.951 6.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -80.07 -7.96 14.22 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 121.69 1.594 . . . . 0.0 113.499 -176.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 49.4 m -71.51 -42.82 67.51 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.443 -0.786 . . . . 0.0 111.794 -178.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -88.56 65.75 7.94 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 122.309 1.052 . . . . 0.0 109.996 176.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -118.41 120.1 36.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.584 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 49.8 m-85 -102.6 153.09 20.44 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.746 -0.782 . . . . 0.0 109.473 -175.51 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.98 -118.86 2.15 Favored Glycine 0 N--CA 1.466 0.639 0 C-N-CA 119.391 -1.385 . . . . 0.0 111.419 -171.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 58.8 mtmt -83.37 81.54 8.67 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.178 178.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.584 ' SD ' ' CB ' ' A' ' 25' ' ' PHE . 86.6 mtp -83.37 -71.52 0.5 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.79 -0.764 . . . . 0.0 110.083 -179.716 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.449 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 35.3 t70 -126.9 31.48 5.28 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.571 0.701 . . . . 0.0 109.813 178.216 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.449 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 95.0 m -150.66 178.4 9.13 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 122.185 0.993 . . . . 0.0 110.86 -171.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -77.8 -175.44 3.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 122.253 1.025 . . . . 0.0 112.162 -171.857 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.1 t-105 -63.36 -51.43 65.93 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.379 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.39 6.52 11.96 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 119.557 -0.857 . . . . 0.0 112.888 -175.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 14.2 m0 -121.31 156.72 31.96 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 169.55 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -142.96 161.72 37.38 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 119.723 -0.791 . . . . 0.0 110.144 -177.44 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' SG ' ' A' ' 11' ' ' CYS . 43.2 m -102.02 153.88 19.48 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 119.651 -0.819 . . . . 0.0 110.054 174.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.9 t -149.82 156.7 42.26 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.933 -179.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -143.44 163.0 34.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 173.905 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -62.84 -46.73 86.54 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 121.302 -0.874 . . . . 0.0 112.657 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 145.09 76.29 0.03 OUTLIER Glycine 0 N--CA 1.465 0.597 0 C-N-CA 119.683 -1.246 . . . . 0.0 110.852 178.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.2 m -153.77 65.14 0.73 Allowed 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.679 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.104 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.43 178.479 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 40.6 p90 . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 122.304 1.05 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -107.97 -64.12 1.25 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.174 -178.433 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -77.94 -49.67 13.68 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 119.499 -0.881 . . . . 0.0 112.011 -177.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 47.4 t -58.94 -36.99 75.7 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 119.876 -0.73 . . . . 0.0 111.997 -179.301 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 -74.29 -37.98 63.51 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.124 -0.63 . . . . 0.0 112.012 178.797 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.7 tptp -67.77 -38.01 82.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.946 179.592 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -64.88 -37.3 87.16 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.615 176.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.42 66.85 0.68 Allowed Glycine 0 N--CA 1.466 0.681 0 N-CA-C 110.245 -1.142 . . . . 0.0 110.245 -178.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -150.97 170.74 30.72 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 119.503 -1.332 . . . . 0.0 111.48 -176.921 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -126.94 152.01 47.71 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 176.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.8 m -80.71 135.5 36.01 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 122.167 0.984 . . . . 0.0 111.418 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.9 m-85 -139.11 143.87 38.52 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.178 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -52.77 163.23 2.05 Favored 'Trans proline' 0 C--N 1.331 -0.361 0 C-N-CA 121.657 1.571 . . . . 0.0 112.213 171.051 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -85.12 45.9 1.22 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.713 -174.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -145.41 -29.02 0.44 Allowed 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -173.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -87.44 172.82 9.52 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 122.273 1.035 . . . . 0.0 111.961 -171.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.5 mt -78.48 139.97 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 122.381 1.086 . . . . 0.0 110.284 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -116.12 142.65 46.53 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 168.586 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.417 ' C ' HD13 ' A' ' 19' ' ' LEU . 1.9 tm? -135.41 114.76 11.5 Favored Pre-proline 0 C--N 1.325 -0.49 0 C-N-CA 119.301 -0.96 . . . . 0.0 108.61 -174.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.97 158.75 96.24 Favored 'Cis proline' 0 CA--C 1.534 0.49 0 C-N-CA 123.375 -1.511 . . . . 0.0 111.699 2.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.92 -27.79 0.87 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 121.163 1.242 . . . . 0.0 114.444 -168.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 50.5 m -94.7 59.26 2.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.15 -0.969 . . . . 0.0 111.434 -172.086 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.4 m -166.18 69.16 0.12 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 175.478 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 p-10 -128.45 130.27 47.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 122.171 0.986 . . . . 0.0 110.538 -176.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.537 ' CB ' ' SD ' ' A' ' 28' ' ' MET . 23.5 m-85 -86.56 170.06 12.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.22 178.426 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.03 -137.84 6.34 Favored Glycine 0 CA--C 1.525 0.718 0 C-N-CA 119.54 -1.314 . . . . 0.0 111.202 -178.037 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -76.22 115.3 15.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.687 -0.805 . . . . 0.0 109.335 177.858 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 36' ' ' CYS . 94.1 mtp -119.42 -95.95 0.48 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.72 -0.792 . . . . 0.0 109.051 -175.695 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.519 ' O ' ' SG ' ' A' ' 30' ' ' CYS . 2.9 m-20 -107.79 53.71 0.68 Allowed 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.33 179.602 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.519 ' SG ' ' O ' ' A' ' 29' ' ' ASP . 58.2 m -152.2 -163.63 1.78 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 179.561 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.94 -178.88 5.73 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 120.932 -1.105 . . . . 0.0 111.681 -171.674 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.8 t-105 -58.23 -51.78 68.31 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 -171.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -95.56 7.55 45.92 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.614 -0.834 . . . . 0.0 113.191 -170.156 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -104.05 162.09 13.44 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.117 -0.989 . . . . 0.0 109.781 -178.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 25' ' ' PHE . 65.7 pttt -132.66 167.3 20.32 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 119.468 -0.893 . . . . 0.0 111.971 -174.683 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.578 ' HB3' ' SD ' ' A' ' 28' ' ' MET . 43.2 t -114.28 106.9 14.89 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.248 0.547 . . . . 0.0 109.653 -174.093 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 33.8 t -92.65 148.4 22.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.161 -1.016 . . . . 0.0 111.801 -174.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -129.92 158.79 38.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.893 0.854 . . . . 0.0 109.098 178.942 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -83.35 -172.28 4.05 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 122.117 0.961 . . . . 0.0 110.59 175.137 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.87 -76.4 1.13 Allowed Glycine 0 CA--C 1.524 0.609 0 C-N-CA 119.774 -1.203 . . . . 0.0 110.446 176.188 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 77.8 p -92.91 70.72 4.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.03 0.919 . . . . 0.0 110.051 177.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.217 0 C-N-CA 119.711 -1.233 . . . . 0.0 110.118 179.936 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 61.8 t80 . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 111.53 0.196 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -88.49 -71.65 0.58 Allowed 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.321 -0.862 . . . . 0.0 110.679 -178.814 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -77.46 -40.98 41.3 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 119.829 -0.748 . . . . 0.0 112.0 -176.172 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 10.5 t -73.1 -28.28 62.18 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -174.673 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -67.34 -28.78 68.25 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -174.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -54.88 -43.71 73.41 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 119.539 -0.865 . . . . 0.0 110.877 171.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -74.86 -48.99 22.09 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.723 173.17 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.28 84.5 1.18 Allowed Glycine 0 N--CA 1.467 0.729 0 C-N-CA 120.277 -0.963 . . . . 0.0 110.853 178.273 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -157.73 163.82 32.83 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 119.135 -1.507 . . . . 0.0 112.616 -176.68 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -120.83 154.93 35.11 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.651 0.739 . . . . 0.0 109.305 177.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.7 m -80.53 139.14 36.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.258 1.028 . . . . 0.0 111.574 -178.156 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -142.59 158.57 59.88 Favored Pre-proline 0 C--N 1.324 -0.501 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 172.791 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -63.51 175.56 2.72 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 121.475 1.45 . . . . 0.0 113.395 -178.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -93.39 75.46 4.51 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.614 0.721 . . . . 0.0 110.459 -176.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -169.29 -32.2 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 119.984 -0.686 . . . . 0.0 112.422 -177.436 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -85.47 172.18 11.2 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 122.55 1.167 . . . . 0.0 112.088 -173.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 98.0 mt -87.74 134.01 28.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.816 -178.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.65 105.25 17.36 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 171.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.439 ' HA ' ' C ' ' A' ' 20' ' ' PRO . 23.9 tp -118.75 132.52 23.85 Favored Pre-proline 0 N--CA 1.469 0.48 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.173 -169.313 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.439 ' C ' ' HA ' ' A' ' 19' ' ' LEU . 62.2 Cg_exo -66.3 167.66 52.73 Favored 'Cis proline' 0 CA--C 1.532 0.411 0 CA-C-N 120.988 1.388 . . . . 0.0 114.0 4.427 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -90.81 75.16 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.398 0 C-N-CA 121.444 1.429 . . . . 0.0 111.122 -169.076 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 79.2 p -140.05 -66.35 0.45 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.511 -177.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.9 m -99.39 81.95 2.6 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.713 0.768 . . . . 0.0 111.27 -172.474 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -106.61 118.08 35.74 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 172.505 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -95.7 153.74 17.57 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.7 -176.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -88.49 -122.77 1.97 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 119.667 -1.254 . . . . 0.0 111.363 -177.072 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -75.69 99.64 4.42 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 119.219 -0.992 . . . . 0.0 109.12 175.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' MET . . . . . . . . . . . . . 90.1 mmm -99.43 -120.39 0.15 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 176.201 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -103.62 40.77 1.37 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 119.089 -1.045 . . . . 0.0 110.714 170.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 62.9 m -93.97 -165.47 1.33 Allowed 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 170.341 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -86.04 -171.21 3.46 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.752 -1.218 . . . . 0.0 109.918 176.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -59.47 -45.59 91.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -170.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -107.82 15.93 24.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -173.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -111.77 172.77 6.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.115 -0.991 . . . . 0.0 110.404 178.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -135.89 171.03 15.06 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 120.153 -0.619 . . . . 0.0 111.003 -174.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 37.3 t -113.71 143.42 44.64 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.787 -0.57 . . . . 0.0 109.94 177.164 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 19.5 t -125.26 143.2 51.07 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.851 0.834 . . . . 0.0 111.444 -175.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -139.25 148.53 43.17 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 173.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -79.66 -177.41 5.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.142 0.972 . . . . 0.0 111.712 178.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -110.47 -70.89 0.64 Allowed Glycine 0 N--CA 1.467 0.756 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 170.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.2 t -151.16 88.91 1.48 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 171.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 119.283 -1.437 . . . . 0.0 111.056 -177.249 . . . . . . . . 0 0 . 1 stop_ save_