data_2k2x_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 2k2x _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 119.424 -0.322 . . . . 20.0 110.802 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.8 m -65.25 -26.2 68.0 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.631 1.173 . . . . 20.0 112.996 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.1 t -65.02 -52.77 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.057 1.343 . . . . 20.0 109.905 167.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 t -63.28 -30.84 71.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.866 1.266 . . . . 20.0 112.94 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.66 -31.22 21.19 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.782 1.233 . . . . 20.0 111.942 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.25 58.88 1.19 Allowed Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.202 1.382 . . . . 20.0 113.324 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -127.44 -178.76 4.58 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.001 2.12 . . . . 20.0 111.25 174.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.91 178.83 32.4 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.27 1.414 . . . . 20.0 113.037 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.5 m -128.37 30.3 5.2 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.545 1.938 . . . . 20.0 112.239 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.6 148.11 67.67 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.111 0.965 . . . . 20.0 110.825 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.93 164.08 36.8 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.136 2.557 . . . . 20.0 111.841 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -60.07 -29.6 68.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.059 1.743 . . . . 20.0 112.221 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.0 m -72.71 -35.19 67.53 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.179 0.992 . . . . 20.0 112.602 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -81.21 -65.65 0.99 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.14 0.976 . . . . 20.0 110.405 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 m -70.51 154.3 94.5 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 123.697 0.799 . . . . 20.0 111.359 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.24 173.39 14.59 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.694 2.929 . . . . 20.0 111.719 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.42 -18.56 61.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.065 1.346 . . . . 20.0 113.037 -174.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -90.7 -36.54 14.27 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.958 2.103 . . . . 20.0 112.877 -175.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.45 -9.74 57.27 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.505 1.522 . . . . 20.0 113.658 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.12 101.46 1.44 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.661 1.585 . . . . 20.0 110.702 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -72.22 164.02 26.96 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.672 1.189 . . . . 20.0 111.106 175.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.9 m -94.39 -11.35 30.08 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.084 1.353 . . . . 20.0 113.172 -175.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -64.88 168.58 6.15 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.67 1.988 . . . . 20.0 112.278 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -123.89 -178.6 15.46 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.889 1.233 . . . . 20.0 113.935 -175.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.93 -16.47 54.3 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.833 2.159 . . . . 20.0 114.444 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.1 m -73.07 -178.63 2.92 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.778 1.231 . . . . 20.0 112.65 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -94.7 -18.0 21.71 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.676 0.79 . . . . 20.0 111.958 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 p -142.1 -73.02 0.31 Allowed 'General case' 0 C--N 1.34 0.177 0 C-N-CA 125.455 1.502 . . . . 20.0 109.454 -173.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.51 148.64 11.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.574 1.549 . . . . 20.0 108.208 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.9 m -84.62 145.68 27.89 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.735 0.414 . . . . 20.0 110.217 173.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 45.2 t -134.49 120.87 20.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.557 1.143 . . . . 20.0 110.124 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.34 88.43 0.64 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.69 1.196 . . . . 20.0 112.747 -178.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.5 mt -66.1 -22.14 66.39 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.555 1.142 . . . . 20.0 112.571 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.1 m -65.68 -22.08 66.6 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 125.812 1.645 . . . . 20.0 112.6 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.8 mttm . . . . . 0 CA--C 1.533 0.324 0 C-N-CA 125.595 1.558 . . . . 20.0 112.569 -170.026 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm . . . . . 0 CA--C 1.535 0.368 0 CA-C-O 118.589 -0.72 . . . . 20.0 112.692 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 141.77 -38.71 1.47 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 124.338 0.971 . . . . 20.0 112.365 167.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 170.64 46.66 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.333 0.968 . . . . 20.0 113.797 171.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -153.59 129.09 9.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.925 1.29 . . . . 20.0 110.369 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.6 m -87.99 128.75 35.39 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.362 1.065 . . . . 20.0 109.121 162.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.35 159.15 73.0 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 126.016 1.727 . . . . 20.0 109.124 168.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.15 160.3 38.94 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.841 3.027 . . . . 20.0 112.723 -170.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.32 -20.64 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.243 1.017 . . . . 20.0 112.362 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -28.29 65.52 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.917 1.687 . . . . 20.0 111.772 175.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.9 ttm-85 -99.45 111.64 23.96 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.448 1.099 . . . . 20.0 110.04 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -73.98 116.31 14.46 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.331 1.453 . . . . 20.0 109.346 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 45.8 t -144.59 -91.54 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.666 1.187 . . . . 20.0 110.276 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.422 ' HE3' ' HA ' ' A' ' 71' ' ' CYS . 22.2 ttpp -154.06 158.24 40.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.229 1.812 . . . . 20.0 109.646 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -131.68 133.08 44.49 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.841 1.256 . . . . 20.0 110.278 -176.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 tp -159.18 103.59 1.65 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.013 1.325 . . . . 20.0 110.144 -171.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -66.27 -6.69 14.73 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.96 1.704 . . . . 20.0 115.061 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.95 78.99 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.324 1.05 . . . . 20.0 113.473 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -137.24 -49.42 0.61 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.282 1.033 . . . . 20.0 111.337 -169.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.5 p -67.82 -10.23 51.12 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.106 1.151 . . . . 20.0 114.106 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.44 -20.57 46.04 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.617 1.339 . . . . 20.0 114.617 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 90.7 p -125.13 34.59 4.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.836 1.254 . . . . 20.0 112.135 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.4 -13.8 59.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.633 0.975 . . . . 20.0 113.633 174.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.15 -103.23 0.89 Allowed Glycine 0 C--N 1.343 0.958 0 C-N-CA 125.349 1.452 . . . . 20.0 110.573 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -70.31 93.72 0.88 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.244 1.417 . . . . 20.0 109.474 173.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.406 ' C ' ' H ' ' A' ' 69' ' ' LYS . . . 94.88 60.18 1.09 Allowed Glycine 0 C--N 1.337 0.617 0 C-N-CA 124.502 1.049 . . . . 20.0 112.614 175.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -75.1 36.4 0.11 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.935 2.494 . . . . 20.0 114.858 177.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' A' ' 67' ' ' GLY . 72.0 mmtt -119.75 99.46 6.66 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.664 1.986 . . . . 20.0 111.703 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.31 125.75 28.53 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.443 1.497 . . . . 20.0 110.962 173.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.422 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 80.5 m -127.5 135.66 50.68 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.828 1.651 . . . . 20.0 109.867 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 CA--C 1.536 0.405 0 C-N-CA 124.886 1.274 . . . . 20.0 108.993 175.636 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 112.58 0.585 . . . . 20.0 112.58 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.0 m -53.58 -59.86 4.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.9 1.68 . . . . 20.0 110.946 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.8 t -64.3 -34.26 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 125.699 1.6 . . . . 20.0 111.387 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -68.78 -16.96 63.95 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.901 1.28 . . . . 20.0 112.925 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -102.29 -7.71 21.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.121 1.768 . . . . 20.0 112.139 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.7 0.08 52.61 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.335 1.922 . . . . 20.0 114.133 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -86.32 177.09 7.58 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.042 1.737 . . . . 20.0 111.131 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.97 -176.54 16.42 Favored Glycine 0 C--N 1.341 0.81 0 C-N-CA 124.851 1.215 . . . . 20.0 113.229 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.31 76.57 1.73 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.795 1.638 . . . . 20.0 109.304 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.09 162.02 75.81 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 125.103 1.361 . . . . 20.0 109.627 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.23 161.76 44.82 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.48 2.12 . . . . 20.0 110.457 170.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.73 -26.92 68.93 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.964 0.906 . . . . 20.0 111.469 171.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.4 m -69.73 -16.31 63.3 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.045 1.338 . . . . 20.0 113.582 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -122.34 -41.83 2.39 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.828 1.251 . . . . 20.0 111.825 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.6 t -67.63 119.46 66.11 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 123.878 0.871 . . . . 20.0 109.883 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.91 163.14 38.66 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.175 2.583 . . . . 20.0 111.276 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -72.32 -3.56 24.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.788 1.635 . . . . 20.0 113.268 -170.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -100.27 -36.51 9.25 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.248 2.619 . . . . 20.0 111.846 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.51 -13.6 59.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.167 1.387 . . . . 20.0 113.589 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -67.02 120.87 14.37 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.888 1.275 . . . . 20.0 110.852 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.4 mt -86.81 178.83 6.88 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.855 1.262 . . . . 20.0 110.829 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -102.22 -1.31 31.53 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.242 1.417 . . . . 20.0 112.688 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -68.02 174.9 3.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.968 1.707 . . . . 20.0 113.398 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.24 -176.77 14.57 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.92 1.724 . . . . 20.0 112.812 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.89 -11.79 59.08 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 126.148 1.832 . . . . 20.0 113.422 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 71.2 m -74.0 175.86 7.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.504 1.152 . . . . 20.0 112.78 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.7 m -106.27 -14.72 15.04 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.917 1.287 . . . . 20.0 111.938 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.2 p -138.01 -69.71 0.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.046 1.738 . . . . 20.0 109.985 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -157.12 156.11 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 125.35 1.46 . . . . 20.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -79.47 161.46 26.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.979 0.912 . . . . 20.0 110.338 171.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -151.35 117.56 5.61 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.638 0.775 . . . . 20.0 110.793 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -70.75 98.77 1.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.643 1.577 . . . . 20.0 110.405 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.3 mt -79.59 -16.46 55.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.402 1.081 . . . . 20.0 113.19 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -71.11 -33.19 69.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.37 1.068 . . . . 20.0 111.455 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 125.117 1.367 . . . . 20.0 112.959 177.691 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 112.576 0.584 . . . . 20.0 112.576 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 166.77 -35.2 0.23 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.617 1.103 . . . . 20.0 112.944 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.13 166.84 15.09 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 125.248 1.404 . . . . 20.0 113.99 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -151.03 167.49 27.5 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.767 1.227 . . . . 20.0 112.68 -172.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.8 m -87.23 66.14 9.1 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.421 1.488 . . . . 20.0 110.848 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.75 158.45 87.77 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.252 1.021 . . . . 20.0 111.177 172.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.86 156.22 66.78 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 124.066 3.177 . . . . 20.0 112.092 -173.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.16 -20.63 65.58 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 20.0 113.083 173.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.47 -15.16 62.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.714 1.606 . . . . 20.0 112.872 175.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.403 HH11 ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -80.9 139.8 35.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 20.0 110.201 178.361 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -80.5 101.83 9.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.796 -0.816 . . . . 20.0 108.796 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.411 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -156.9 175.49 14.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.07 1.348 . . . . 20.0 109.995 179.55 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -76.91 159.12 30.26 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.697 0.799 . . . . 20.0 109.715 170.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -125.18 144.15 50.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.603 1.161 . . . . 20.0 110.117 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.6 170.71 14.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.403 2.281 . . . . 20.0 110.19 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -104.02 -4.07 23.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.059 1.744 . . . . 20.0 110.812 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.37 -82.46 0.08 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.101 1.76 . . . . 20.0 111.564 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.2 -32.68 61.28 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.135 1.374 . . . . 20.0 112.542 -173.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.94 -25.04 67.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.511 1.124 . . . . 20.0 111.934 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.51 -19.82 63.72 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.355 1.062 . . . . 20.0 113.663 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.8 m -66.53 -56.19 11.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.992 1.317 . . . . 20.0 110.269 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 83.1 m -70.83 -21.79 62.4 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.859 0.864 . . . . 20.0 112.01 173.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.47 -94.06 1.67 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.945 2.212 . . . . 20.0 112.736 172.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -138.48 164.04 30.4 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.782 1.633 . . . . 20.0 111.754 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.57 -16.82 59.93 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.926 1.251 . . . . 20.0 112.783 -170.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 178.5 4.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.988 1.715 . . . . 20.0 112.417 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -150.32 156.21 41.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.579 2.751 . . . . 20.0 108.697 169.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 37.4 t -73.97 133.04 42.98 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.597 -0.52 . . . . 20.0 109.597 172.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.6 t -156.06 163.32 39.82 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.666 1.187 . . . . 20.0 110.351 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 124.906 1.283 . . . . 20.0 110.588 176.526 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 112.036 0.384 . . . . 20.0 112.036 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.75 -36.7 83.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.079 0.952 . . . . 20.0 111.983 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.3 t -68.44 -43.3 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.894 1.278 . . . . 20.0 110.513 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.0 m -62.57 -42.82 99.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.175 0.99 . . . . 20.0 111.967 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -66.13 -22.08 66.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.775 1.23 . . . . 20.0 112.663 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.0 3.34 55.87 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.513 1.53 . . . . 20.0 114.597 176.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.91 -179.53 3.23 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.425 1.49 . . . . 20.0 111.684 174.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.6 171.91 13.98 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.955 1.264 . . . . 20.0 113.382 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.08 63.38 0.79 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.715 1.606 . . . . 20.0 110.071 176.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.03 156.21 92.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 124.522 1.129 . . . . 20.0 109.874 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.21 160.67 48.75 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.663 2.242 . . . . 20.0 110.6 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -63.59 -23.15 67.27 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.078 0.951 . . . . 20.0 111.385 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.3 t -59.87 -57.02 14.67 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.016 1.327 . . . . 20.0 111.039 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -85.58 -45.64 11.56 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.589 0.756 . . . . 20.0 111.436 -169.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -65.07 124.27 86.3 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.165 0.986 . . . . 20.0 110.416 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -69.09 161.58 45.26 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.915 2.41 . . . . 20.0 110.776 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -77.75 -0.46 27.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.934 1.294 . . . . 20.0 113.65 -169.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -102.79 -35.23 8.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.25 2.22 . . . . 20.0 112.521 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.95 -12.77 61.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.477 1.111 . . . . 20.0 113.638 175.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -66.99 121.21 15.05 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 124.773 1.229 . . . . 20.0 110.508 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.3 mt -84.26 169.74 14.41 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.803 1.241 . . . . 20.0 112.569 -176.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.6 p -84.36 -16.54 42.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 20.0 112.627 175.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -73.91 172.58 11.33 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.703 2.001 . . . . 20.0 111.809 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.78 -179.15 15.95 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.734 1.635 . . . . 20.0 111.775 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.23 25.18 1.69 Allowed Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.378 0.99 . . . . 20.0 113.845 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.6 m -128.29 -179.77 5.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.671 1.588 . . . . 20.0 111.8 -173.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.6 m -104.5 -11.78 16.84 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.749 0.819 . . . . 20.0 112.215 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.3 p -138.4 -66.81 0.48 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.922 1.289 . . . . 20.0 109.807 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.0 155.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.251 1.82 . . . . 20.0 108.934 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.8 m -82.65 160.1 22.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.035 0.534 . . . . 20.0 110.701 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 t -147.16 119.08 8.13 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.368 0.667 . . . . 20.0 110.051 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -69.75 99.32 1.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.237 1.415 . . . . 20.0 110.262 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 mt -77.23 -13.55 59.92 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.249 1.02 . . . . 20.0 112.663 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.7 t -85.02 -16.11 41.87 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.647 1.579 . . . . 20.0 113.218 -177.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.4 pttp . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 124.88 1.272 . . . . 20.0 113.212 175.001 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 113.218 0.821 . . . . 20.0 113.218 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.54 35.39 0.65 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.196 1.379 . . . . 20.0 111.912 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.16 157.47 27.68 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.139 1.352 . . . . 20.0 113.637 -173.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -146.32 155.84 42.92 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.894 1.278 . . . . 20.0 109.822 -175.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 18.8 t -106.55 111.91 24.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.794 1.638 . . . . 20.0 109.135 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -141.48 156.33 66.91 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 127.305 2.242 . . . . 20.0 110.291 -167.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.23 161.25 34.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.226 2.617 . . . . 20.0 113.497 -170.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.489 ' HA ' ' HZ3' ' A' ' 69' ' ' LYS . 86.0 mt -67.07 -18.43 65.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.808 0.843 . . . . 20.0 112.238 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -66.85 -22.39 65.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.066 1.747 . . . . 20.0 112.041 172.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.38 122.95 26.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.56 1.544 . . . . 20.0 109.138 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -69.93 104.06 2.41 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.587 1.155 . . . . 20.0 110.574 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 t -159.82 175.75 12.73 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.388 1.475 . . . . 20.0 110.296 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -78.38 141.38 38.41 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.672 1.189 . . . . 20.0 109.372 171.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.84 133.24 49.16 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.121 1.368 . . . . 20.0 109.172 173.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.22 122.16 23.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.393 1.877 . . . . 20.0 111.041 -170.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -64.43 -15.96 61.55 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.748 1.619 . . . . 20.0 114.129 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.47 63.91 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.268 1.427 . . . . 20.0 113.793 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -139.17 -37.68 0.51 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.672 1.189 . . . . 20.0 112.518 -168.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.8 t -64.42 -29.39 70.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.5 1.12 . . . . 20.0 112.447 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.62 72.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.581 0.752 . . . . 20.0 111.711 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.0 m -79.58 -33.14 41.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.045 1.338 . . . . 20.0 111.972 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.7 m -63.87 -34.02 77.01 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.388 1.075 . . . . 20.0 111.47 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.68 170.84 47.25 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 125.728 1.632 . . . . 20.0 112.796 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 126.24 26.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.648 1.179 . . . . 20.0 111.627 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 114.23 -19.68 17.19 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.689 1.614 . . . . 20.0 113.298 -178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -138.44 177.32 7.97 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.222 1.809 . . . . 20.0 111.98 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.489 ' HZ3' ' HA ' ' A' ' 50' ' ' LEU . 5.9 ptpp? -151.31 173.37 14.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.827 2.051 . . . . 20.0 111.492 -176.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.0 t -91.5 147.17 23.21 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.067 0.547 . . . . 20.0 109.779 163.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 49.9 t -144.0 161.17 39.45 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.758 1.223 . . . . 20.0 109.936 172.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.2 t . . . . . 0 CA--C 1.537 0.464 0 C-N-CA 126.251 1.821 . . . . 20.0 109.033 -179.309 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 CA--C 1.532 0.287 0 N-CA-C 112.035 0.383 . . . . 20.0 112.035 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.32 -36.27 81.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.373 1.069 . . . . 20.0 111.97 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 63.0 t -76.71 -41.99 33.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.49 1.516 . . . . 20.0 110.776 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 t -61.59 -44.16 97.53 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.182 1.393 . . . . 20.0 111.976 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -68.25 -12.97 61.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.469 1.508 . . . . 20.0 113.164 176.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.43 1.28 56.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.145 1.355 . . . . 20.0 114.603 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -74.71 175.17 8.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.57 1.185 . . . . 20.0 112.09 -178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -103.6 175.9 23.77 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.014 1.292 . . . . 20.0 112.399 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -132.77 65.77 1.58 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.599 1.559 . . . . 20.0 109.42 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.94 158.12 87.65 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.135 0.974 . . . . 20.0 110.028 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.34 165.49 30.32 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.183 2.589 . . . . 20.0 111.389 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -60.92 -32.47 71.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.205 0.602 . . . . 20.0 111.374 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -65.66 -45.69 82.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.096 0.958 . . . . 20.0 112.162 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.61 -49.85 10.73 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.024 0.93 . . . . 20.0 111.725 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -67.64 124.94 90.52 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.193 0.997 . . . . 20.0 110.574 -179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.74 160.78 48.17 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.802 2.335 . . . . 20.0 110.25 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -73.09 -18.49 61.3 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.732 0.813 . . . . 20.0 112.735 -170.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.4 -41.17 33.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.98 2.112 . . . . 20.0 112.365 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -9.02 58.2 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.69 1.196 . . . . 20.0 113.488 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -70.5 113.7 7.88 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.518 1.127 . . . . 20.0 110.748 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 37.4 mt -84.88 170.74 12.82 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.187 1.395 . . . . 20.0 111.957 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 98.0 p -82.44 -13.64 56.43 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.337 1.055 . . . . 20.0 113.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -74.76 175.25 8.14 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.804 1.241 . . . . 20.0 112.591 -175.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -137.14 -176.93 14.66 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.35 1.452 . . . . 20.0 112.317 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.46 -4.73 33.04 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.508 1.528 . . . . 20.0 113.332 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.8 m -78.9 176.33 9.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.663 1.185 . . . . 20.0 111.984 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.8 t -111.54 -6.86 14.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.238 1.415 . . . . 20.0 111.579 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.6 p -131.6 -75.42 0.52 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.165 1.786 . . . . 20.0 109.021 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.2 p -165.58 151.89 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 126.852 2.061 . . . . 20.0 108.358 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.6 m -67.8 154.71 40.95 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.388 0.675 . . . . 20.0 111.497 172.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.3 t -151.06 113.69 4.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.589 0.755 . . . . 20.0 110.132 174.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -69.57 102.72 1.9 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.96 0.904 . . . . 20.0 110.165 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 mt -68.7 -22.28 64.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.189 0.996 . . . . 20.0 111.941 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 t -82.9 -7.0 59.7 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.823 1.649 . . . . 20.0 112.884 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt . . . . . 0 N--CA 1.472 0.658 0 C-N-CA 125.243 1.417 . . . . 20.0 112.803 179.116 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.6 mmtm . . . . . 0 N--CA 1.466 0.358 0 N-CA-C 113.434 0.901 . . . . 20.0 113.434 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.34 31.94 2.48 Favored Glycine 0 CA--C 1.532 1.138 0 CA-C-O 118.847 -0.974 . . . . 20.0 112.538 -170.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.67 179.41 20.17 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.714 1.626 . . . . 20.0 112.21 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -119.88 166.57 13.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.163 1.385 . . . . 20.0 112.323 -171.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 49.2 m -90.84 -43.14 10.23 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.268 1.027 . . . . 20.0 113.758 -173.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.68 171.03 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.217 2.207 . . . . 20.0 114.537 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.85 149.58 66.48 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.261 1.974 . . . . 20.0 110.713 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.58 -24.23 65.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.001 1.32 . . . . 20.0 113.076 177.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -78.11 -8.44 58.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.978 1.711 . . . . 20.0 113.076 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 164.73 26.0 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.587 1.155 . . . . 20.0 110.374 170.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -107.56 104.15 13.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.533 1.533 . . . . 20.0 109.265 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -158.78 167.67 28.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.957 1.703 . . . . 20.0 110.602 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.55 160.45 31.46 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.889 1.275 . . . . 20.0 111.818 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -133.22 114.26 13.61 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 126.247 1.819 . . . . 20.0 109.494 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pp -136.29 103.38 5.28 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.955 1.702 . . . . 20.0 110.235 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -61.26 -12.16 12.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.635 1.974 . . . . 20.0 113.564 -173.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.67 95.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.796 1.638 . . . . 20.0 113.325 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -119.74 -40.39 2.76 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.897 1.279 . . . . 20.0 111.429 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.3 p -70.52 -15.22 62.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.544 1.138 . . . . 20.0 113.911 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.8 18.65 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.534 1.309 . . . . 20.0 114.534 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 59.7 p -112.73 17.86 18.74 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.894 1.678 . . . . 20.0 113.572 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.8 m -67.27 -83.41 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.66 1.184 . . . . 20.0 111.286 174.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.2 -28.84 9.29 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.143 1.354 . . . . 20.0 114.399 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -136.11 35.84 2.8 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.303 1.441 . . . . 20.0 112.805 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -166.69 -45.86 0.02 OUTLIER Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.159 -0.801 . . . . 20.0 113.59 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.55 25.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 129.003 2.921 . . . . 20.0 117.017 -172.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.07 129.42 46.61 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 126.949 2.1 . . . . 20.0 108.749 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.2 t -110.38 127.92 55.32 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.989 0.916 . . . . 20.0 109.279 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.7 t -129.59 120.85 25.97 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.113 1.365 . . . . 20.0 108.855 -174.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 124.974 1.309 . . . . 20.0 108.092 -171.8 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 119.289 -0.386 . . . . 20.0 111.768 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 m -63.91 -39.1 93.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.915 -0.565 . . . . 20.0 111.431 173.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.0 t -66.89 -35.4 74.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.192 0.997 . . . . 20.0 111.132 174.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -65.61 -35.46 80.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.139 0.976 . . . . 20.0 112.106 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.55 -28.06 41.25 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.592 1.157 . . . . 20.0 112.326 176.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.75 -1.32 32.06 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.408 1.48 . . . . 20.0 114.126 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -70.22 176.67 3.73 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.387 1.475 . . . . 20.0 111.588 172.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.96 179.13 20.5 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 125.263 1.411 . . . . 20.0 113.234 -175.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.9 m -132.56 54.43 1.95 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.153 1.781 . . . . 20.0 110.423 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.57 159.92 64.12 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.367 1.467 . . . . 20.0 111.276 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -68.92 158.31 58.42 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.463 2.109 . . . . 20.0 110.931 171.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.13 -24.65 67.77 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.451 1.1 . . . . 20.0 111.589 176.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.7 m -72.62 -19.53 61.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.222 1.409 . . . . 20.0 113.458 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -107.12 -54.34 2.49 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.758 1.223 . . . . 20.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.92 120.55 67.55 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.603 1.161 . . . . 20.0 110.259 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -68.46 165.55 28.68 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.977 2.451 . . . . 20.0 110.735 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -71.16 -14.62 62.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.904 0.882 . . . . 20.0 113.129 -170.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -85.18 -40.7 16.4 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.499 2.32 . . . . 20.0 112.432 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.06 -7.16 52.92 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.634 1.574 . . . . 20.0 113.613 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.57 107.68 5.21 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.458 1.503 . . . . 20.0 110.961 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -72.57 168.32 18.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.004 1.322 . . . . 20.0 112.139 177.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -89.48 -13.94 36.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.43 1.492 . . . . 20.0 112.75 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -66.25 172.31 4.01 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.103 2.161 . . . . 20.0 111.992 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -138.97 -175.83 14.25 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.683 1.135 . . . . 20.0 113.18 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.4 -11.29 56.74 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.115 1.817 . . . . 20.0 113.632 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.3 m -69.7 175.09 4.45 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.58 1.152 . . . . 20.0 112.782 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.5 p -100.06 -14.52 18.58 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.656 1.583 . . . . 20.0 111.84 -176.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 p -141.6 -72.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.917 2.087 . . . . 20.0 109.156 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -159.05 154.02 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.481 1.512 . . . . 20.0 108.703 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 67.9 m -72.45 161.15 31.19 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.883 0.473 . . . . 20.0 111.711 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.3 120.86 6.92 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.163 0.985 . . . . 20.0 109.988 171.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -70.24 92.84 0.8 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 20.0 111.827 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.8 -37.07 86.38 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.496 1.119 . . . . 20.0 112.182 -174.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.1 t -63.04 -31.61 72.79 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.494 1.118 . . . . 20.0 111.95 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp . . . . . 0 CA--C 1.534 0.363 0 C-N-CA 124.429 1.091 . . . . 20.0 113.396 -176.897 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mptt . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 119.218 -0.42 . . . . 20.0 112.008 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 86.0 -26.25 6.24 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.475 1.988 . . . . 20.0 112.907 -172.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.17 -171.3 48.83 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.175 1.369 . . . . 20.0 114.066 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.3 176.58 7.83 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.447 1.499 . . . . 20.0 112.002 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.0 t -108.46 101.48 10.65 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.007 1.323 . . . . 20.0 110.15 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -130.32 154.64 81.52 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 128.352 2.661 . . . . 20.0 110.945 -170.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.83 162.1 41.08 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.159 2.572 . . . . 20.0 113.221 -170.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.417 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 83.8 mt -66.39 -20.9 66.19 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.138 0.575 . . . . 20.0 112.142 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -69.37 -20.06 63.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.814 1.646 . . . . 20.0 112.391 174.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -68.46 144.59 54.61 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.371 1.068 . . . . 20.0 109.286 171.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -90.1 100.82 13.57 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.306 0.642 . . . . 20.0 109.797 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.39 176.73 9.54 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.737 1.615 . . . . 20.0 111.014 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -117.44 109.94 17.38 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.038 1.335 . . . . 20.0 111.138 -171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HA ' ' H ' ' A' ' 70' ' ' CYS . 1.8 pm0 -64.84 173.31 2.34 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.271 2.229 . . . . 20.0 114.507 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.1 mt -147.41 129.87 15.83 Favored 'General case' 0 C--N 1.347 0.462 0 C-N-CA 126.578 1.951 . . . . 20.0 109.847 167.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -64.29 -12.49 42.09 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.505 0.928 . . . . 20.0 113.505 166.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.86 -70.86 0.43 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.408 1.483 . . . . 20.0 110.969 167.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -85.31 -49.63 8.01 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.07 0.948 . . . . 20.0 112.865 -166.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 p -70.17 -7.01 38.41 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.615 1.166 . . . . 20.0 113.398 -174.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.79 -14.3 62.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.31 1.444 . . . . 20.0 113.663 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.9 t -64.8 -54.83 24.95 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.843 1.257 . . . . 20.0 112.584 -175.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.7 m -74.37 -15.44 60.93 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 118.709 -0.663 . . . . 20.0 112.322 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.39 -154.73 35.08 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-N 119.382 0.992 . . . . 20.0 112.925 175.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -60.19 110.34 1.2 Allowed 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.224 1.41 . . . . 20.0 110.602 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 124.59 -0.1 8.59 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.517 1.532 . . . . 20.0 113.325 -175.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -119.96 149.1 42.67 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.567 1.547 . . . . 20.0 111.596 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 17.2 ptpt -141.34 151.23 43.39 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.779 2.031 . . . . 20.0 109.461 165.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.521 ' H ' ' HA ' ' A' ' 56' ' ' GLU . 8.5 t -63.67 132.28 50.61 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.369 -0.604 . . . . 20.0 109.369 172.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.3 t -157.17 115.09 3.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.778 0.831 . . . . 20.0 110.37 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.617 1.167 . . . . 20.0 111.029 170.421 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 . . . . . 0 N--CA 1.465 0.294 0 CA-C-O 119.239 -0.41 . . . . 20.0 110.827 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 39.1 m -64.28 -36.63 84.72 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.879 1.272 . . . . 20.0 112.876 -172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.8 t -65.6 -46.03 90.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.186 1.394 . . . . 20.0 110.815 174.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 -40.87 98.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.736 1.614 . . . . 20.0 112.828 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -69.96 -27.78 65.01 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.823 1.649 . . . . 20.0 112.924 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.15 41.72 2.96 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.586 -1.119 . . . . 20.0 113.61 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -120.86 175.27 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.519 1.528 . . . . 20.0 111.72 176.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 171.51 26.68 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 124.913 1.245 . . . . 20.0 113.678 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.8 m -126.77 39.95 3.82 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.052 1.741 . . . . 20.0 111.318 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.74 153.84 20.44 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 20.0 110.934 175.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.45 155.97 65.47 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.618 2.212 . . . . 20.0 111.358 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.64 -20.25 66.17 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.776 1.231 . . . . 20.0 111.696 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -76.16 -8.69 57.59 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.825 1.65 . . . . 20.0 113.224 173.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -118.21 -66.65 1.06 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.618 1.567 . . . . 20.0 110.542 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.24 147.54 98.84 Favored Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 118.299 0.5 . . . . 20.0 112.04 -174.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.11 167.24 27.86 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.525 2.817 . . . . 20.0 111.147 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.52 9.99 8.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.973 1.709 . . . . 20.0 113.236 -170.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -121.45 -34.78 3.38 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 126.52 1.928 . . . . 20.0 113.193 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.04 -7.81 44.16 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.291 1.436 . . . . 20.0 112.973 173.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.03 108.29 4.52 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.611 1.564 . . . . 20.0 111.614 -175.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.8 mt -72.35 169.82 15.49 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.085 1.754 . . . . 20.0 112.797 -176.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.3 p -86.55 -17.71 33.35 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.152 1.381 . . . . 20.0 112.927 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -71.78 171.92 10.76 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.518 1.927 . . . . 20.0 111.913 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.99 149.71 19.64 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 125.313 1.435 . . . . 20.0 110.313 169.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 156.26 23.42 0.03 OUTLIER Glycine 0 CA--C 1.531 1.056 0 CA-C-O 118.633 -1.093 . . . . 20.0 114.004 -176.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.8 m -135.91 176.88 8.28 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.426 1.49 . . . . 20.0 112.115 -172.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -89.4 -19.59 25.0 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.461 1.104 . . . . 20.0 112.302 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -142.37 -66.39 0.39 Allowed 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.19 1.396 . . . . 20.0 110.747 -168.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.87 141.19 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.926 1.29 . . . . 20.0 109.466 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.4 m -78.64 104.44 9.25 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.625 1.17 . . . . 20.0 109.604 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.9 t -100.56 117.2 34.21 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.226 1.01 . . . . 20.0 110.819 -177.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -66.71 99.68 0.63 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.079 1.752 . . . . 20.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.0 mt -74.49 -18.27 60.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.367 1.067 . . . . 20.0 112.943 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.4 t -72.37 -21.68 61.25 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.268 1.027 . . . . 20.0 112.822 -176.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 126.031 1.732 . . . . 20.0 113.58 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.7 mttm . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 119.399 -0.334 . . . . 20.0 111.893 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.2 -7.91 32.89 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.662 2.077 . . . . 20.0 113.066 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.74 156.66 6.22 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.618 1.58 . . . . 20.0 112.531 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -92.41 140.19 29.83 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.038 0.935 . . . . 20.0 110.281 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.94 8.67 22.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.851 1.66 . . . . 20.0 113.092 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.72 150.25 1.3 Allowed Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.389 2.676 . . . . 20.0 113.44 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -64.92 159.84 44.17 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 123.196 2.597 . . . . 20.0 112.849 -170.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 71.7 mt -62.49 -20.51 64.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.342 0.657 . . . . 20.0 112.501 170.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -78.45 -17.62 56.08 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.562 1.545 . . . . 20.0 113.24 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 158.01 33.02 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.642 1.177 . . . . 20.0 110.807 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -70.92 -9.28 57.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.807 1.643 . . . . 20.0 114.641 -174.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.9 m -60.07 154.93 18.11 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 125.336 1.454 . . . . 20.0 111.61 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -154.38 118.32 4.7 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.126 1.37 . . . . 20.0 110.687 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 6.8 tp10 -158.75 -168.67 2.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.248 1.419 . . . . 20.0 109.887 174.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.512 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.9 pp -59.7 158.35 10.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.962 1.705 . . . . 20.0 113.146 171.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -114.84 -10.28 12.38 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.694 1.598 . . . . 20.0 113.291 174.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.15 -56.26 24.35 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 124.058 0.943 . . . . 20.0 112.295 -176.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -85.6 -27.56 25.4 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.893 0.877 . . . . 20.0 112.362 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.48 -32.77 74.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.1 0.96 . . . . 20.0 112.668 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.87 -1.76 0.71 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.507 2.323 . . . . 20.0 115.921 -168.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.6 m -58.66 -22.7 57.6 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.87 1.268 . . . . 20.0 113.594 172.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.43 -8.44 58.49 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.758 1.163 . . . . 20.0 113.793 171.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 89.02 -73.77 2.1 Favored Glycine 0 C--N 1.343 0.935 0 C-N-CA 125.433 1.492 . . . . 20.0 112.306 172.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -133.43 151.64 51.83 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.182 1.793 . . . . 20.0 109.098 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.0 42.45 98.23 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 118.344 -1.253 . . . . 20.0 113.772 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.19 157.92 40.45 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.896 1.278 . . . . 20.0 112.239 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 12.9 ptpt -166.12 132.9 2.63 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.55 1.54 . . . . 20.0 110.512 171.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 156.76 36.33 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.788 0.435 . . . . 20.0 111.207 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.5 t -164.99 13.62 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.736 0.814 . . . . 20.0 112.698 -170.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.1 t . . . . . 0 CA--C 1.538 0.496 0 C-N-CA 125.037 1.335 . . . . 20.0 111.103 -169.523 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 N--CA 1.463 0.214 0 CA-C-O 119.343 -0.361 . . . . 20.0 110.421 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.7 t -62.92 -42.75 99.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.588 0.755 . . . . 20.0 112.327 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.33 -39.82 72.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.01 0.924 . . . . 20.0 110.796 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 t -63.04 -34.05 76.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.822 1.249 . . . . 20.0 112.899 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -74.39 -19.14 60.53 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.795 1.638 . . . . 20.0 112.706 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.37 14.59 35.04 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.945 1.26 . . . . 20.0 114.538 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -75.4 175.04 8.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.765 1.283 . . . . 20.0 112.231 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.5 1.95 13.97 Favored Glycine 0 C--N 1.343 0.962 0 N-CA-C 117.481 1.752 . . . . 20.0 117.481 -160.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m 34.34 61.92 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.266 2.627 . . . . 20.0 113.69 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.5 157.05 87.13 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.296 0.638 . . . . 20.0 109.939 173.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.04 165.39 32.74 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.985 2.457 . . . . 20.0 111.156 174.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -59.87 -38.95 83.66 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.498 0.719 . . . . 20.0 110.664 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 88.9 p -67.38 -10.05 47.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.009 1.724 . . . . 20.0 115.056 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -122.24 -45.05 2.24 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 124.753 1.221 . . . . 20.0 111.001 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.2 t -65.14 119.44 58.89 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.926 1.29 . . . . 20.0 110.331 175.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.15 155.09 72.19 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.357 2.038 . . . . 20.0 110.201 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -69.37 -19.68 63.83 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.215 1.006 . . . . 20.0 112.641 -167.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -74.97 -39.12 61.46 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.76 2.424 . . . . 20.0 112.675 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.47 -9.66 59.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.508 1.123 . . . . 20.0 113.459 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -69.72 117.53 11.43 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 124.007 0.923 . . . . 20.0 110.528 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 mt -88.06 176.38 7.33 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.519 1.528 . . . . 20.0 111.46 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.3 p -105.45 -6.75 19.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.335 1.454 . . . . 20.0 114.004 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.97 172.54 7.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.712 1.205 . . . . 20.0 111.855 175.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.27 177.39 17.2 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.877 1.227 . . . . 20.0 112.771 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.14 -4.1 31.61 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.767 1.651 . . . . 20.0 114.397 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.3 m -77.4 179.85 6.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.233 1.413 . . . . 20.0 112.468 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.7 m -103.16 -11.95 17.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.4 1.08 . . . . 20.0 112.233 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 p -138.32 -71.98 0.41 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.055 1.742 . . . . 20.0 109.654 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -158.36 153.39 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 126.196 1.798 . . . . 20.0 108.724 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 60.9 m -74.26 155.04 38.68 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.519 0.728 . . . . 20.0 111.033 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.9 t -149.32 114.2 5.39 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.394 0.678 . . . . 20.0 110.526 176.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.27 108.58 4.25 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.496 1.118 . . . . 20.0 110.915 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.63 -27.4 58.41 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.763 0.825 . . . . 20.0 113.088 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -73.95 -11.79 60.45 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.084 1.142 . . . . 20.0 114.084 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt . . . . . 0 CA--C 1.541 0.612 0 C-N-CA 127.075 2.15 . . . . 20.0 111.355 179.79 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp . . . . . 0 CA--C 1.536 0.411 0 N-CA-C 112.823 0.675 . . . . 20.0 112.823 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.61 -43.04 1.15 Allowed Glycine 0 C--N 1.339 0.702 0 C-N-CA 125.262 1.41 . . . . 20.0 111.146 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.37 167.58 43.78 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.497 1.523 . . . . 20.0 112.459 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.18 157.85 44.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.503 1.921 . . . . 20.0 110.819 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -82.06 109.36 16.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.152 0.981 . . . . 20.0 109.394 173.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -127.1 155.01 76.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.236 2.214 . . . . 20.0 109.971 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.45 164.78 27.25 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.981 3.121 . . . . 20.0 113.428 -168.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 48.6 mt -59.97 -28.85 68.01 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.518 0.727 . . . . 20.0 111.588 168.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.21 -18.51 65.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.696 1.598 . . . . 20.0 112.725 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -65.98 -30.47 71.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.621 1.168 . . . . 20.0 112.316 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.88 1.11 0.78 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.646 2.378 . . . . 20.0 115.612 173.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.6 p -65.59 167.76 8.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.805 1.242 . . . . 20.0 111.68 172.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -63.68 134.15 54.87 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.253 1.021 . . . . 20.0 110.018 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.96 172.55 12.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.611 1.165 . . . . 20.0 112.116 175.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 162.54 29.47 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.978 2.111 . . . . 20.0 110.979 172.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -88.02 -2.28 58.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.633 1.573 . . . . 20.0 113.336 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.29 -70.2 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.483 1.513 . . . . 20.0 110.742 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -83.98 -27.19 28.63 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.499 0.926 . . . . 20.0 113.499 -176.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.3 p -66.19 -21.94 66.33 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.14 -11.0 35.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.993 1.317 . . . . 20.0 112.685 173.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.6 t -107.34 -30.57 8.62 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.887 1.675 . . . . 20.0 112.198 171.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 75.0 m -61.61 -27.23 68.51 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.368 0.986 . . . . 20.0 112.516 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.5 166.77 42.81 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.249 1.404 . . . . 20.0 112.712 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -62.94 133.84 55.27 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.789 1.236 . . . . 20.0 111.067 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.27 -2.41 65.5 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.162 1.363 . . . . 20.0 113.353 -172.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -149.96 137.8 20.15 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.921 1.361 . . . . 20.0 111.814 -170.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.58 172.37 12.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.642 1.977 . . . . 20.0 112.146 -174.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.89 137.58 51.76 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 122.009 -0.432 . . . . 20.0 109.976 167.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.6 t -138.27 168.33 19.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.783 1.633 . . . . 20.0 108.576 163.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.466 0.33 0 C-N-CA 123.169 0.587 . . . . 20.0 109.966 170.392 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 111.366 0.136 . . . . 20.0 111.366 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.4 t -70.65 -37.42 73.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.542 1.137 . . . . 20.0 112.239 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.31 -37.63 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.305 . . . . 20.0 110.709 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.2 t -58.28 -37.55 75.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.875 1.27 . . . . 20.0 112.075 178.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -77.77 -46.28 22.13 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.518 1.127 . . . . 20.0 111.575 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.59 63.63 2.56 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.419 1.009 . . . . 20.0 112.378 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -95.28 -102.26 0.16 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.57 1.548 . . . . 20.0 108.741 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.58 165.58 35.08 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.153 1.359 . . . . 20.0 111.416 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.9 m -125.45 55.96 1.39 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.276 1.43 . . . . 20.0 110.132 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.42 154.74 90.13 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.074 0.95 . . . . 20.0 109.803 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -69.79 160.08 51.02 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.026 2.484 . . . . 20.0 110.408 170.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.9 -37.31 84.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.768 0.827 . . . . 20.0 112.074 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.0 m -68.72 -21.69 64.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.781 1.03 . . . . 20.0 113.781 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -92.06 -51.13 5.34 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.503 1.121 . . . . 20.0 110.571 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.3 t -62.93 118.51 43.05 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 125.517 1.527 . . . . 20.0 110.941 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.01 155.57 69.13 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.382 2.055 . . . . 20.0 110.206 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -74.08 -16.26 61.04 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.627 1.171 . . . . 20.0 112.72 -165.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.55 -39.82 64.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.649 2.38 . . . . 20.0 112.239 170.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.16 -11.18 59.77 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.612 1.165 . . . . 20.0 113.455 -176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -67.54 112.68 4.83 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.806 0.842 . . . . 20.0 110.694 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.6 mt -78.12 175.99 9.62 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.368 1.867 . . . . 20.0 111.153 174.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.7 p -110.81 -0.25 17.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.719 1.608 . . . . 20.0 112.804 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -72.07 171.57 11.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.73 1.212 . . . . 20.0 111.906 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -129.69 141.84 13.02 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.032 1.301 . . . . 20.0 111.275 174.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 150.09 -14.69 1.0 Allowed Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.763 1.173 . . . . 20.0 114.101 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -77.72 -179.55 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.899 1.35 . . . . 20.0 112.371 172.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.1 t -107.02 -9.53 16.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.496 1.518 . . . . 20.0 111.766 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 p -137.54 -69.61 0.45 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 125.425 1.49 . . . . 20.0 110.158 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.2 p -159.26 144.32 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 20.0 109.86 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 92.4 m -72.99 120.33 18.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.537 1.535 . . . . 20.0 110.173 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.0 t -126.33 108.34 11.15 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.544 1.138 . . . . 20.0 110.607 -171.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -65.04 106.09 1.19 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.54 1.936 . . . . 20.0 111.29 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.2 mt -80.67 -18.2 48.77 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.934 0.894 . . . . 20.0 112.913 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -77.51 -10.57 59.56 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.761 1.225 . . . . 20.0 113.398 -175.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt . . . . . 0 CA--C 1.536 0.427 0 C-N-CA 126.05 1.74 . . . . 20.0 112.998 172.67 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt . . . . . 0 CA--C 1.537 0.45 0 N-CA-C 112.5 0.556 . . . . 20.0 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.6 -24.54 16.8 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.617 1.58 . . . . 20.0 114.094 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.53 -162.66 37.12 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.708 1.147 . . . . 20.0 114.275 173.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -120.99 141.35 50.81 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.121 1.768 . . . . 20.0 109.208 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.9 t -89.05 17.08 6.14 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.928 1.291 . . . . 20.0 113.153 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -43.9 153.02 0.43 Allowed Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 128.92 2.888 . . . . 20.0 114.378 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.85 161.87 44.28 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.618 2.878 . . . . 20.0 112.474 -177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.8 mt -63.62 -18.96 64.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.846 1.258 . . . . 20.0 112.272 172.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -69.45 -25.65 64.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.356 1.463 . . . . 20.0 112.577 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -69.95 160.59 31.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.183 0.993 . . . . 20.0 111.238 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -74.33 97.77 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.381 1.072 . . . . 20.0 110.896 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 98.7 m -153.77 154.84 34.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.782 2.433 . . . . 20.0 109.07 174.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -154.99 92.21 1.43 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.076 1.35 . . . . 20.0 110.394 175.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.48 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.5 tp10 -153.94 -174.7 5.06 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.191 0.996 . . . . 20.0 110.897 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.48 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.5 pp -57.07 158.46 5.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.965 1.706 . . . . 20.0 113.826 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -118.56 -9.11 10.34 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.751 2.021 . . . . 20.0 112.654 175.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -20.0 65.0 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.053 1.341 . . . . 20.0 114.069 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -124.67 -17.92 5.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.344 1.458 . . . . 20.0 111.843 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.5 t -79.29 -20.94 46.76 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.978 1.311 . . . . 20.0 113.498 177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -0.46 5.72 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.239 1.415 . . . . 20.0 114.449 -174.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.6 t -56.64 -45.01 81.85 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.75 1.22 . . . . 20.0 111.602 166.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -69.99 -6.41 33.12 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.485 1.114 . . . . 20.0 113.461 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.21 -166.62 14.57 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.714 1.626 . . . . 20.0 112.389 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.03 46.42 0.39 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.416 1.886 . . . . 20.0 110.537 168.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -150.33 3.99 0.57 Allowed Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.46 1.981 . . . . 20.0 113.329 -173.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -142.61 152.98 43.07 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.675 1.738 . . . . 20.0 110.817 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -132.49 147.98 52.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.582 2.353 . . . . 20.0 108.114 165.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.2 t -60.8 142.74 55.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.848 0.356 . . . . 20.0 111.074 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.9 t -158.17 4.66 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.038 0.755 . . . . 20.0 113.038 -171.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.347 1.459 . . . . 20.0 111.69 -179.047 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 119.341 -0.362 . . . . 20.0 110.698 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 p -68.46 -28.25 66.88 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 114.557 1.317 . . . . 20.0 114.557 -167.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.0 t -57.27 -49.34 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.544 1.138 . . . . 20.0 109.617 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.4 t -71.65 -27.26 62.95 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.733 1.213 . . . . 20.0 112.786 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -67.52 -24.97 65.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.208 1.003 . . . . 20.0 112.419 175.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.23 -1.11 14.52 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.181 1.372 . . . . 20.0 114.176 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -77.95 172.14 13.93 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.753 1.277 . . . . 20.0 112.222 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.9 -7.04 29.73 Favored Glycine 0 C--N 1.341 0.839 0 N-CA-C 118.019 1.968 . . . . 20.0 118.019 -153.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.0 m 37.54 53.93 1.41 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.801 2.44 . . . . 20.0 113.76 -171.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.55 154.25 80.27 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 123.166 0.587 . . . . 20.0 109.646 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.7 161.97 41.41 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.86 2.373 . . . . 20.0 111.256 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -65.64 -18.33 65.24 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.403 0.681 . . . . 20.0 111.604 175.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.7 m -68.29 -43.57 77.42 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.681 1.192 . . . . 20.0 112.231 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -89.4 -48.34 7.4 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.821 0.848 . . . . 20.0 112.285 -174.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.19 118.92 51.28 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.004 1.321 . . . . 20.0 110.683 -176.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -71.06 157.99 56.32 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.916 2.41 . . . . 20.0 110.042 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -73.26 -16.58 61.39 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.0 0.92 . . . . 20.0 112.954 -164.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -72.44 -40.47 67.05 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.174 2.59 . . . . 20.0 112.221 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 -6.78 59.51 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.615 1.566 . . . . 20.0 113.616 -176.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -71.53 101.99 2.6 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 123.868 0.867 . . . . 20.0 111.036 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.73 170.86 7.19 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.085 1.754 . . . . 20.0 111.178 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.6 t -110.47 -3.21 16.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.486 1.514 . . . . 20.0 112.984 -174.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -63.74 175.38 1.13 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.243 1.817 . . . . 20.0 111.85 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.79 178.53 16.35 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.235 1.398 . . . . 20.0 112.754 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.06 -3.85 33.63 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.97 1.271 . . . . 20.0 115.085 171.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.7 m -77.48 176.38 8.94 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.196 1.498 . . . . 20.0 113.143 177.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -85.7 -17.67 35.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.728 -1.124 . . . . 20.0 110.84 166.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -143.08 -70.83 0.32 Allowed 'General case' 0 C--N 1.344 0.357 0 C-N-CA 125.428 1.491 . . . . 20.0 111.783 -168.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -164.88 137.38 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.506 1.522 . . . . 20.0 109.412 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -70.48 128.09 34.95 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.439 1.096 . . . . 20.0 109.491 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.8 t -130.89 114.71 15.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.574 1.149 . . . . 20.0 110.609 -172.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -67.11 121.4 15.53 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.327 0.584 . . . . 20.0 112.138 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.47 -26.22 14.91 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.694 1.198 . . . . 20.0 112.164 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.2 m -68.55 -10.94 58.93 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.397 1.479 . . . . 20.0 114.187 -173.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.3 ptmm? . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 126.419 1.887 . . . . 20.0 113.17 -175.651 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 113.401 0.889 . . . . 20.0 113.401 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 105.67 54.37 0.73 Allowed Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.559 1.076 . . . . 20.0 112.016 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.62 177.5 18.99 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 124.974 1.273 . . . . 20.0 113.357 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.32 157.53 45.42 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.563 1.545 . . . . 20.0 112.581 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -101.28 44.96 0.99 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.13 2.172 . . . . 20.0 111.185 -168.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -63.72 163.88 19.2 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.624 1.97 . . . . 20.0 113.49 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.31 163.46 34.36 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.824 3.016 . . . . 20.0 112.83 -177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.5 mt -68.04 -20.46 64.98 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.656 1.182 . . . . 20.0 112.003 171.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.99 -39.99 96.41 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.928 1.691 . . . . 20.0 111.031 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -74.37 132.45 42.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.305 1.042 . . . . 20.0 109.058 173.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.73 122.83 22.99 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.145 0.578 . . . . 20.0 110.062 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -168.7 166.44 11.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.401 1.48 . . . . 20.0 111.233 176.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -77.58 166.16 23.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.939 1.296 . . . . 20.0 110.665 174.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -132.6 140.65 48.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.449 1.499 . . . . 20.0 110.393 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.1 118.59 16.88 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.785 2.034 . . . . 20.0 110.885 -171.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -63.32 -17.45 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.986 1.314 . . . . 20.0 114.527 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.76 -20.38 61.19 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.95 1.3 . . . . 20.0 113.834 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -139.32 -37.0 0.51 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.97 . . . . 20.0 112.286 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.9 t -69.55 -21.55 63.62 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.749 1.219 . . . . 20.0 112.724 178.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.09 -8.78 18.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.888 0.875 . . . . 20.0 112.822 172.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.7 t -100.49 -26.76 13.74 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.288 1.435 . . . . 20.0 112.436 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 94.3 m -66.38 -44.64 82.57 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.178 0.899 . . . . 20.0 110.632 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 68.75 -179.27 22.87 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.603 1.097 . . . . 20.0 113.487 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -50.12 135.17 21.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.735 1.614 . . . . 20.0 112.398 -176.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.19 -28.58 15.08 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.194 1.854 . . . . 20.0 113.242 -175.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -142.51 -178.79 5.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.5 1.52 . . . . 20.0 111.734 -176.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -165.72 152.59 10.0 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.962 1.305 . . . . 20.0 111.361 -175.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.93 148.16 36.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.252 0.621 . . . . 20.0 110.128 166.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 20.2 t -149.21 140.82 23.44 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.918 1.687 . . . . 20.0 108.292 170.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 CA--C 1.539 0.539 0 C-N-CA 124.927 1.291 . . . . 20.0 109.257 -169.46 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 118.99 -0.529 . . . . 20.0 111.876 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -58.66 -38.51 78.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.269 0.627 . . . . 20.0 110.785 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.14 -43.26 95.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.489 1.516 . . . . 20.0 110.986 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.3 m -63.26 -36.25 83.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.408 1.083 . . . . 20.0 112.41 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.1 -12.06 60.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.875 1.27 . . . . 20.0 112.751 176.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.59 1.19 53.07 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.61 1.576 . . . . 20.0 115.008 173.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -79.54 179.92 7.2 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.61 1.564 . . . . 20.0 111.995 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.1 174.91 15.44 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.603 1.573 . . . . 20.0 113.064 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.3 m -118.24 41.87 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.134 1.374 . . . . 20.0 112.054 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 143.9 97.49 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 122.976 0.51 . . . . 20.0 109.885 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.58 166.62 29.33 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.439 2.759 . . . . 20.0 112.797 -173.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -64.38 -25.74 68.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.564 1.545 . . . . 20.0 112.362 178.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.2 m -77.72 -12.85 60.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.435 1.494 . . . . 20.0 113.815 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.87 -66.97 1.03 Allowed 'General case' 0 C--N 1.344 0.351 0 C-N-CA 124.577 1.151 . . . . 20.0 110.513 -170.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.4 158.54 28.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.462 0.705 . . . . 20.0 112.075 176.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -83.13 170.13 12.38 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.847 3.031 . . . . 20.0 111.892 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -83.77 -5.65 59.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.335 1.454 . . . . 20.0 113.337 -173.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -90.75 -32.43 16.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.82 2.048 . . . . 20.0 112.196 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.02 2.63 12.24 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.909 1.684 . . . . 20.0 113.672 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -85.7 102.73 13.87 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.221 1.008 . . . . 20.0 112.704 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.1 mt -74.77 176.42 7.05 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.346 1.858 . . . . 20.0 111.721 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.9 t -137.2 19.15 2.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.169 1.388 . . . . 20.0 113.226 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.06 -100.71 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.563 1.945 . . . . 20.0 111.176 171.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.16 177.8 28.8 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 128.178 2.799 . . . . 20.0 111.407 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.33 38.0 3.64 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 119.092 -0.838 . . . . 20.0 113.931 176.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 68.9 m -132.8 179.39 6.19 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.556 1.543 . . . . 20.0 111.171 176.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.1 m -108.65 -6.28 16.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.397 1.079 . . . . 20.0 112.284 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.1 p -136.77 -67.79 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.644 1.578 . . . . 20.0 109.852 174.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -165.81 163.2 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 127.75 2.42 . . . . 20.0 107.946 -173.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.8 m -97.49 157.73 15.85 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.556 0.743 . . . . 20.0 111.727 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.3 t -146.34 118.22 8.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.418 1.487 . . . . 20.0 109.94 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.96 96.89 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.424 1.09 . . . . 20.0 113.215 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.7 mt -69.26 -9.01 51.18 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.844 1.258 . . . . 20.0 113.585 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.1 t -101.1 -7.58 23.06 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.966 1.306 . . . . 20.0 112.795 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm . . . . . 0 CA--C 1.535 0.386 0 C-N-CA 125.882 1.673 . . . . 20.0 112.898 -177.89 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 112.753 0.649 . . . . 20.0 112.753 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.66 -14.48 2.92 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.395 1.474 . . . . 20.0 114.407 174.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.67 172.11 48.62 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.353 1.454 . . . . 20.0 112.745 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -136.8 171.34 14.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.591 1.556 . . . . 20.0 111.438 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 57.3 m -74.68 25.09 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.138 2.175 . . . . 20.0 114.565 -172.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -55.46 154.02 13.08 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 125.088 1.355 . . . . 20.0 111.116 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.44 163.11 38.52 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.553 2.835 . . . . 20.0 111.782 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.76 -13.89 62.51 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.08 1.352 . . . . 20.0 112.512 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -68.87 -31.78 70.97 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.209 1.404 . . . . 20.0 111.825 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -72.39 135.05 45.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.596 0.758 . . . . 20.0 109.82 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -80.84 104.28 11.25 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.362 1.465 . . . . 20.0 110.952 -176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.477 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 1.3 m -162.04 165.55 27.13 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.466 1.906 . . . . 20.0 110.274 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -68.48 162.11 26.29 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.37 1.068 . . . . 20.0 111.671 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -133.96 125.11 27.51 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.406 1.482 . . . . 20.0 110.855 -173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.9 pp -129.26 170.96 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.319 2.247 . . . . 20.0 110.817 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.67 -5.4 13.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.762 1.225 . . . . 20.0 112.018 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.6 -34.72 62.89 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.56 1.544 . . . . 20.0 113.131 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -138.34 -36.71 0.58 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.422 1.489 . . . . 20.0 111.855 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.6 p -90.12 48.47 1.57 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.079 1.752 . . . . 20.0 110.441 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -130.06 -7.68 4.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.635 1.974 . . . . 20.0 111.98 177.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.7 m -133.8 84.44 2.12 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.769 1.228 . . . . 20.0 111.354 -176.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.5 t -141.12 -55.72 0.49 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 155.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 160.6 -80.78 0.15 Allowed Glycine 0 C--N 1.341 0.861 0 CA-C-N 118.7 0.682 . . . . 20.0 112.175 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -80.24 65.3 5.35 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 126.443 1.897 . . . . 20.0 110.922 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 45.93 78.85 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 128.464 2.935 . . . . 20.0 112.443 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -63.68 133.84 54.32 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.448 -0.876 . . . . 20.0 109.204 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HE2' ' HB2' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -142.39 130.64 22.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.115 0.966 . . . . 20.0 111.203 171.387 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.2 t -53.25 120.0 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.46 1.904 . . . . 20.0 111.722 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.9 t -158.97 85.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.743 0.817 . . . . 20.0 110.446 -172.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.48 1.059 0 C-N-CA 124.406 1.082 . . . . 20.0 113.082 -174.848 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 112.098 0.407 . . . . 20.0 112.098 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 t -61.31 -47.05 87.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.349 1.46 . . . . 20.0 111.871 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 88.8 t -77.58 -31.34 17.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.455 1.502 . . . . 20.0 111.411 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.2 m -63.7 -41.92 98.04 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.508 1.123 . . . . 20.0 111.738 173.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.55 -16.61 61.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.05 0.94 . . . . 20.0 112.879 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.64 52.67 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.786 1.184 . . . . 20.0 114.306 172.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -83.73 178.52 7.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.365 1.466 . . . . 20.0 112.321 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.52 175.26 15.67 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.493 1.521 . . . . 20.0 112.449 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.6 m -123.27 52.56 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.297 1.439 . . . . 20.0 111.144 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.65 153.04 88.47 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.008 0.923 . . . . 20.0 109.55 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.85 164.09 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.005 2.47 . . . . 20.0 111.63 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -62.42 -27.8 69.35 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.414 1.486 . . . . 20.0 111.229 172.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.6 m -64.66 -34.06 77.41 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 125.184 1.394 . . . . 20.0 112.473 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.37 -70.08 0.64 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.243 1.017 . . . . 20.0 110.518 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 m -69.94 144.22 92.8 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 124.168 0.987 . . . . 20.0 111.492 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.04 170.64 17.59 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.045 3.164 . . . . 20.0 111.781 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -70.44 -23.49 62.73 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.584 1.154 . . . . 20.0 113.218 -170.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -81.77 -36.88 28.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.265 2.226 . . . . 20.0 112.459 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.86 -8.07 52.14 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.928 1.291 . . . . 20.0 113.486 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -72.15 101.69 2.85 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.115 1.366 . . . . 20.0 110.813 -178.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.93 169.96 10.65 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.123 1.769 . . . . 20.0 111.742 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.6 p -98.17 -11.67 22.54 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.339 1.456 . . . . 20.0 113.743 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -69.42 163.62 24.84 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.437 1.095 . . . . 20.0 112.032 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.55 174.49 15.49 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.207 1.384 . . . . 20.0 111.849 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.29 -3.97 20.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.045 1.307 . . . . 20.0 113.787 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.32 179.41 5.89 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.263 1.425 . . . . 20.0 112.363 175.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -97.46 -13.67 21.61 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.64 1.176 . . . . 20.0 112.042 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -142.94 -71.07 0.32 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.761 1.624 . . . . 20.0 110.33 -173.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -159.1 145.29 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.461 1.104 . . . . 20.0 109.927 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.0 m -77.35 131.83 38.28 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.503 1.121 . . . . 20.0 109.702 169.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.6 t -124.32 118.8 27.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.623 1.169 . . . . 20.0 109.592 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.83 86.18 0.5 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.713 1.205 . . . . 20.0 112.536 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 mt -63.72 -30.97 72.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.517 1.127 . . . . 20.0 112.68 -178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.1 t -64.11 -34.77 78.81 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 123.919 0.888 . . . . 20.0 111.55 177.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 69.1 mttt . . . . . 0 N--CA 1.467 0.381 0 C-N-CA 124.304 1.042 . . . . 20.0 112.759 -174.521 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 107.921 -1.14 . . . . 20.0 107.921 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.0 29.05 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.406 1.003 . . . . 20.0 113.012 -166.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.7 -125.14 3.05 Favored Glycine 0 C--N 1.343 0.942 0 C-N-CA 125.038 1.304 . . . . 20.0 111.513 -174.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.82 167.02 23.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.478 1.111 . . . . 20.0 112.653 -171.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 32.7 t -112.1 82.09 1.57 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.317 1.447 . . . . 20.0 109.937 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.6 164.64 36.63 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 126.04 1.736 . . . . 20.0 111.104 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.94 167.98 20.07 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.587 2.858 . . . . 20.0 112.921 -175.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.3 mt -64.63 -19.82 65.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.315 1.046 . . . . 20.0 112.65 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.29 -27.02 69.05 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.855 1.662 . . . . 20.0 111.926 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -70.46 127.84 34.11 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 125.021 1.328 . . . . 20.0 109.731 -177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -75.29 101.13 4.59 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.415 0.686 . . . . 20.0 110.247 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 p -160.97 -179.98 7.98 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.698 1.599 . . . . 20.0 111.194 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -59.38 165.54 2.72 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.715 2.006 . . . . 20.0 111.648 -177.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -139.44 128.55 23.81 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 125.855 1.662 . . . . 20.0 109.63 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.6 mt -150.79 115.29 5.16 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.422 1.889 . . . . 20.0 109.769 176.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -64.9 -18.93 65.63 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.529 0.936 . . . . 20.0 113.529 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.02 -17.21 60.55 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.964 1.305 . . . . 20.0 114.032 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -129.54 -49.99 1.16 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.707 1.203 . . . . 20.0 112.593 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.5 p -63.73 -18.59 64.19 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.025 1.12 . . . . 20.0 114.025 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.62 -13.5 42.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.467 1.507 . . . . 20.0 113.54 173.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 t -63.28 -46.03 88.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.522 1.129 . . . . 20.0 111.451 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -12.2 57.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.415 0.686 . . . . 20.0 112.539 169.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.61 -162.33 34.43 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.766 1.174 . . . . 20.0 112.664 178.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -74.83 46.46 0.29 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.511 1.924 . . . . 20.0 113.445 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.6 7.94 1.55 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 126.48 1.991 . . . . 20.0 112.528 173.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -144.86 161.74 38.56 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.848 1.259 . . . . 20.0 110.642 176.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.05 149.1 34.49 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.391 2.676 . . . . 20.0 108.444 173.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.6 t -52.64 109.0 0.35 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.854 0.862 . . . . 20.0 111.268 -173.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.36 18.29 13.68 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.154 0.982 . . . . 20.0 113.228 -167.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 C--N 1.343 0.3 0 C-N-CA 125.356 1.463 . . . . 20.0 107.995 -170.24 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 111.657 0.243 . . . . 20.0 111.657 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -58.4 -54.78 43.11 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.324 1.45 . . . . 20.0 111.279 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 50.9 t -67.52 -34.4 68.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.119 1.368 . . . . 20.0 111.066 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.9 t -62.42 -41.48 98.72 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.101 1.361 . . . . 20.0 111.589 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -76.04 -14.02 60.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.609 1.164 . . . . 20.0 113.03 175.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.51 -2.03 53.41 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.781 1.658 . . . . 20.0 113.867 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -76.66 176.98 7.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.383 1.473 . . . . 20.0 111.714 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.79 176.45 18.16 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.886 1.232 . . . . 20.0 111.986 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -124.82 76.39 1.51 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.775 1.23 . . . . 20.0 108.702 172.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -77.53 156.1 81.0 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.339 1.056 . . . . 20.0 109.534 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.94 160.13 51.09 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.5 2.134 . . . . 20.0 111.34 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -64.75 -20.85 66.59 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.986 0.914 . . . . 20.0 112.715 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.0 t -68.11 -55.72 11.45 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.017 0.927 . . . . 20.0 110.896 172.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.03 -54.97 9.3 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.45 1.1 . . . . 20.0 111.775 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 t -62.35 115.86 19.02 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.363 1.065 . . . . 20.0 110.889 -177.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -69.04 156.45 65.18 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.785 2.323 . . . . 20.0 110.592 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -72.84 -17.0 61.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.819 0.848 . . . . 20.0 112.977 -166.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -72.61 -40.91 66.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.288 2.635 . . . . 20.0 111.97 173.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.37 -10.68 59.75 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.036 1.334 . . . . 20.0 112.937 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -66.46 119.5 11.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.202 1.001 . . . . 20.0 110.78 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -90.54 172.82 8.43 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.025 1.33 . . . . 20.0 110.715 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 t -87.54 -14.79 39.28 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.809 1.244 . . . . 20.0 112.204 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -63.64 165.34 8.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.408 1.483 . . . . 20.0 112.538 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.83 -168.77 11.9 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.177 1.37 . . . . 20.0 113.343 -171.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.2 -11.11 73.12 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.224 1.869 . . . . 20.0 113.421 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 77.2 m -67.17 172.23 4.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.62 1.168 . . . . 20.0 111.748 174.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.2 p -106.33 -5.77 18.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.097 1.759 . . . . 20.0 113.533 173.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -139.36 -72.64 0.39 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.266 1.827 . . . . 20.0 109.993 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -164.11 155.32 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.982 1.713 . . . . 20.0 109.002 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -76.02 160.02 30.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.883 0.873 . . . . 20.0 110.403 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.95 117.97 5.9 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.952 0.501 . . . . 20.0 110.825 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -71.74 93.74 1.31 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.805 1.242 . . . . 20.0 110.377 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.95 -22.28 64.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.452 1.101 . . . . 20.0 112.888 -177.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.0 t -74.14 -15.52 61.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.746 1.218 . . . . 20.0 113.023 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? . . . . . 0 CA--C 1.534 0.338 0 C-N-CA 125.767 1.627 . . . . 20.0 113.243 175.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt . . . . . 0 N--CA 1.466 0.355 0 N-CA-C 111.819 0.303 . . . . 20.0 111.819 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 151.23 -25.25 0.99 Allowed Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.456 1.503 . . . . 20.0 112.881 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 98.86 156.57 29.24 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.637 1.589 . . . . 20.0 111.192 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -137.42 136.02 37.45 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 125.159 1.383 . . . . 20.0 109.34 -179.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.8 m -82.56 94.89 7.6 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.405 0.682 . . . . 20.0 109.518 174.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.63 154.7 60.12 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 125.809 1.643 . . . . 20.0 110.858 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -68.39 156.48 65.49 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.676 2.917 . . . . 20.0 112.362 -170.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.91 -19.84 65.8 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.595 0.758 . . . . 20.0 112.665 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -69.04 -27.02 65.27 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.929 1.692 . . . . 20.0 112.577 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -76.38 134.32 39.68 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.335 0.654 . . . . 20.0 109.993 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.15 99.22 0.87 Allowed 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.631 1.172 . . . . 20.0 110.157 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.33 173.43 8.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.866 1.266 . . . . 20.0 111.472 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -68.25 166.95 15.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.534 1.133 . . . . 20.0 111.439 177.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -142.95 140.19 31.0 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.188 1.795 . . . . 20.0 109.447 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.48 87.75 1.74 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.354 1.461 . . . . 20.0 111.337 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -68.18 -9.57 47.79 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.749 1.018 . . . . 20.0 113.749 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.43 -7.62 40.97 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.547 1.539 . . . . 20.0 113.534 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.25 -56.78 0.65 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.922 1.289 . . . . 20.0 111.047 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 t -66.27 -20.55 66.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.221 1.408 . . . . 20.0 113.184 -176.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.63 -6.65 1.21 Allowed 'General case' 0 C--N 1.344 0.365 0 C-N-CA 126.966 2.106 . . . . 20.0 114.963 -178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.1 t -54.58 -28.84 48.97 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.391 0.996 . . . . 20.0 113.362 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.4 -75.69 0.12 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.22 1.008 . . . . 20.0 109.142 165.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 145.13 -62.64 0.47 Allowed Glycine 0 C--N 1.347 1.144 0 C-N-CA 123.918 0.771 . . . . 20.0 112.463 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 144.12 50.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.982 1.313 . . . . 20.0 110.291 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 55.59 46.92 80.19 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.037 1.303 . . . . 20.0 113.069 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -127.5 -0.11 6.23 Favored 'General case' 0 C--N 1.347 0.471 0 N-CA-C 118.837 2.902 . . . . 20.0 118.837 -165.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -41.15 127.3 2.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.113 2.165 . . . . 20.0 113.981 -168.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 44.4 t -60.49 111.93 1.78 Allowed 'General case' 0 C--N 1.345 0.388 0 C-N-CA 123.904 0.881 . . . . 20.0 109.751 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.6 t -130.17 83.43 2.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.957 1.303 . . . . 20.0 108.332 -174.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 CA--C 1.529 0.166 0 C-N-CA 126.016 1.727 . . . . 20.0 108.276 -177.029 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.964 0.727 . . . . 20.0 112.964 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.7 t -63.4 -35.99 82.23 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.473 1.109 . . . . 20.0 111.895 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.4 t -76.74 -41.95 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.376 1.47 . . . . 20.0 110.634 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.6 m -62.17 -38.65 89.87 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.88 1.272 . . . . 20.0 112.743 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -71.67 -15.94 62.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.736 1.214 . . . . 20.0 113.085 175.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.67 -1.07 56.77 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 125.211 1.386 . . . . 20.0 114.535 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -74.59 176.71 6.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.465 1.132 . . . . 20.0 111.333 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 178.65 19.18 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.049 1.309 . . . . 20.0 112.57 -176.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -131.63 68.31 1.5 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.383 1.473 . . . . 20.0 109.67 176.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.54 155.75 87.88 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 109.238 -0.653 . . . . 20.0 109.238 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.79 166.7 28.7 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.7 2.267 . . . . 20.0 111.018 174.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -63.64 -22.49 66.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.602 0.761 . . . . 20.0 111.753 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -74.04 -16.39 61.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.434 1.494 . . . . 20.0 113.899 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -126.1 -37.92 2.21 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.894 1.278 . . . . 20.0 112.597 -174.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -71.22 125.89 91.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 123.861 0.864 . . . . 20.0 110.039 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -69.12 153.53 71.74 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.688 2.258 . . . . 20.0 109.752 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -73.44 -14.4 61.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.361 1.065 . . . . 20.0 112.955 -167.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -76.56 -42.08 44.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.693 2.397 . . . . 20.0 112.226 174.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.9 -11.5 59.82 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.808 1.243 . . . . 20.0 113.577 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -67.34 108.07 2.63 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.301 1.04 . . . . 20.0 111.127 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.6 mt -76.07 172.39 12.86 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.883 1.273 . . . . 20.0 112.334 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 55.9 m -90.51 -11.22 40.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.192 1.397 . . . . 20.0 112.953 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -71.71 175.06 6.0 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.799 1.24 . . . . 20.0 112.96 -176.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.21 177.52 18.17 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.524 1.535 . . . . 20.0 112.681 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.34 -11.06 26.36 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.972 1.749 . . . . 20.0 113.373 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.2 m -74.67 178.36 5.47 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.395 1.478 . . . . 20.0 112.263 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 m -115.55 -5.17 12.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.164 1.386 . . . . 20.0 112.322 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -138.75 -74.63 0.38 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.683 1.993 . . . . 20.0 109.204 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -161.1 158.83 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 126.636 1.974 . . . . 20.0 108.271 179.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 31.8 m -75.18 163.07 27.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.808 0.843 . . . . 20.0 111.358 171.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.87 118.66 5.77 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.194 0.997 . . . . 20.0 110.084 170.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -69.3 100.45 1.34 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.811 1.245 . . . . 20.0 109.547 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 mt -67.95 -24.95 65.23 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.318 1.047 . . . . 20.0 112.267 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.8 t -74.93 -5.7 45.21 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.153 1.381 . . . . 20.0 112.499 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.2 mttt . . . . . 0 N--CA 1.467 0.425 0 C-N-CA 125.934 1.694 . . . . 20.0 111.981 174.479 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt . . . . . 0 CA--C 1.532 0.27 0 N-CA-C 108.72 -0.844 . . . . 20.0 108.72 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.56 -49.03 0.02 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.838 1.209 . . . . 20.0 111.705 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.39 101.11 0.69 Allowed Glycine 0 C--N 1.342 0.89 0 C-N-CA 124.454 1.026 . . . . 20.0 111.271 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.18 150.31 47.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.872 0.869 . . . . 20.0 111.472 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.4 t -110.87 28.66 8.49 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.821 1.648 . . . . 20.0 111.711 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -45.14 149.8 0.86 Allowed Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 127.809 2.444 . . . . 20.0 113.821 159.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.88 159.45 41.73 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.12 3.213 . . . . 20.0 112.84 -171.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.33 -18.78 64.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.332 1.053 . . . . 20.0 113.759 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.09 -29.8 67.97 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.994 1.318 . . . . 20.0 112.624 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.442 ' HB3' ' HZ2' ' A' ' 69' ' ' LYS . 2.9 tpt180 -73.06 138.91 46.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.571 0.748 . . . . 20.0 110.664 -175.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -71.73 104.27 3.34 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.204 1.401 . . . . 20.0 111.329 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -163.5 177.99 8.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.034 1.734 . . . . 20.0 110.077 173.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -69.0 162.49 26.71 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.653 1.181 . . . . 20.0 110.814 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -148.32 134.76 19.62 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.785 1.234 . . . . 20.0 109.978 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.8 mt -146.18 110.91 5.19 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 126.594 1.958 . . . . 20.0 108.729 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.95 -21.67 66.24 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.114 0.783 . . . . 20.0 113.114 -176.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.05 -35.74 74.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.429 1.092 . . . . 20.0 112.185 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -108.24 -31.19 7.99 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.881 1.273 . . . . 20.0 111.89 -170.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.8 p -84.1 -4.8 59.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.283 1.433 . . . . 20.0 113.828 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.3 -9.1 37.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.454 1.102 . . . . 20.0 113.012 174.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.7 t -60.86 -56.34 22.28 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.529 1.532 . . . . 20.0 112.258 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -79.31 -12.45 59.93 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.805 0.73 . . . . 20.0 112.184 172.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.19 -164.81 44.43 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.741 1.162 . . . . 20.0 112.588 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -54.76 107.56 0.3 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.096 1.758 . . . . 20.0 111.635 177.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 134.18 -17.7 4.29 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.288 1.423 . . . . 20.0 112.824 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -110.59 147.99 33.09 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-N 118.967 1.383 . . . . 20.0 111.017 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.442 ' HZ2' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -132.17 153.81 50.18 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.141 1.777 . . . . 20.0 109.706 175.269 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.2 t -66.89 96.77 0.44 Allowed 'General case' 0 C--N 1.346 0.443 0 C-N-CA 124.581 1.152 . . . . 20.0 110.92 -176.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 10.8 t -143.39 111.49 6.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.073 1.349 . . . . 20.0 109.811 -176.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 CA--C 1.534 0.347 0 C-N-CA 124.049 0.94 . . . . 20.0 110.302 177.439 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 . . . . . 0 CA--C 1.536 0.411 0 N-CA-C 110.476 -0.194 . . . . 20.0 110.476 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 m -68.64 -27.57 66.12 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.98 1.712 . . . . 20.0 112.774 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.2 -53.3 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.175 1.39 . . . . 20.0 109.981 169.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 t -61.77 -33.53 74.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.237 1.015 . . . . 20.0 112.274 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -72.91 -56.77 4.7 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.566 1.146 . . . . 20.0 110.561 173.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.22 53.07 0.4 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.497 1.522 . . . . 20.0 112.978 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -116.98 179.71 3.94 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.671 1.589 . . . . 20.0 111.396 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.28 168.4 19.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.218 0.914 . . . . 20.0 112.697 -175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.8 m -120.58 83.93 2.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.235 1.414 . . . . 20.0 108.897 174.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -98.78 155.65 36.45 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.669 1.188 . . . . 20.0 108.468 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.86 162.15 42.83 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.652 2.235 . . . . 20.0 111.184 173.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -62.23 -28.42 69.68 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.7 1.2 . . . . 20.0 111.329 173.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -73.2 -16.14 61.43 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.719 1.208 . . . . 20.0 113.818 175.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -97.39 -66.27 0.91 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.415 1.086 . . . . 20.0 110.34 175.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.6 m -72.0 143.18 86.11 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.876 0.87 . . . . 20.0 111.234 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.21 173.38 13.09 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 124.384 3.389 . . . . 20.0 111.178 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -74.04 7.77 2.47 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.564 1.546 . . . . 20.0 113.841 -172.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -123.54 -38.13 2.57 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.624 1.97 . . . . 20.0 112.699 -172.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.59 -15.4 63.41 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.339 1.056 . . . . 20.0 113.304 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.77 109.86 3.54 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 126.118 1.767 . . . . 20.0 110.421 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.35 169.58 17.37 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.393 1.477 . . . . 20.0 111.683 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -103.22 -6.64 21.9 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.103 1.361 . . . . 20.0 112.813 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.44 176.07 1.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.881 1.672 . . . . 20.0 111.215 167.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.34 174.49 22.85 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 123.865 0.745 . . . . 20.0 113.6 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.03 -4.42 20.5 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 126.182 1.849 . . . . 20.0 114.384 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.3 m -73.22 -177.52 2.56 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.68 1.24 . . . . 20.0 111.471 165.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.1 m -99.52 -10.69 21.82 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.813 0.845 . . . . 20.0 111.899 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.4 p -138.95 -70.68 0.41 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.955 1.702 . . . . 20.0 109.513 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -157.47 144.37 9.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.117 1.367 . . . . 20.0 109.186 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.45 132.92 35.34 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.482 0.713 . . . . 20.0 109.619 173.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.8 t -126.19 114.93 18.98 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.961 1.304 . . . . 20.0 109.613 -174.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -67.38 99.83 0.77 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 124.788 1.235 . . . . 20.0 110.106 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.4 mt -68.73 -27.89 66.33 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.303 1.041 . . . . 20.0 112.149 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -72.98 -10.12 59.46 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.053 1.341 . . . . 20.0 112.957 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mttt . . . . . 0 CA--C 1.539 0.549 0 C-N-CA 125.613 1.565 . . . . 20.0 111.175 174.35 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 110.173 -0.306 . . . . 20.0 110.173 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 161.63 -15.79 0.16 Allowed Glycine 0 CA--C 1.534 1.277 0 CA-C-O 118.63 -1.094 . . . . 20.0 114.468 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.98 176.4 37.98 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.618 1.209 . . . . 20.0 113.449 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -145.59 157.64 43.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.61 1.164 . . . . 20.0 110.924 177.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.5 t -86.62 22.5 1.89 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.422 2.289 . . . . 20.0 112.127 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -58.93 148.91 68.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.893 1.277 . . . . 20.0 111.049 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.75 166.09 28.75 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 124.242 3.295 . . . . 20.0 113.469 -166.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.72 -23.85 65.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.378 1.071 . . . . 20.0 112.605 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -71.92 -13.03 61.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.261 1.424 . . . . 20.0 113.085 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.3 tpt85 -78.71 153.52 30.82 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.518 1.127 . . . . 20.0 110.269 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -102.68 101.63 11.76 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.533 1.133 . . . . 20.0 109.443 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 p -169.63 161.44 9.43 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.176 1.79 . . . . 20.0 111.077 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -80.88 110.14 16.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.087 1.755 . . . . 20.0 111.447 -173.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -79.6 151.41 30.63 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.46 0.704 . . . . 20.0 110.573 168.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.79 16.48 2.5 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.895 1.678 . . . . 20.0 114.54 175.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 51.85 21.37 1.42 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 130.251 3.42 . . . . 20.0 116.989 169.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -129.3 -71.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.271 1.429 . . . . 20.0 110.402 -167.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -63.47 -36.69 84.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 20.0 111.23 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.2 t -69.12 -32.03 71.15 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.18 1.792 . . . . 20.0 113.441 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.35 -7.06 16.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.009 1.324 . . . . 20.0 114.341 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.8 m -59.65 -42.6 93.16 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.227 1.411 . . . . 20.0 111.844 171.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 19.4 m -79.13 -11.47 59.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.839 1.256 . . . . 20.0 113.331 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 88.57 -98.83 2.47 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 125.319 1.438 . . . . 20.0 111.467 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -132.08 161.5 33.1 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.749 1.619 . . . . 20.0 110.588 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.63 -8.3 74.31 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.965 1.269 . . . . 20.0 113.598 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -123.75 178.61 5.15 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.849 1.66 . . . . 20.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -146.18 162.89 37.02 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.134 1.774 . . . . 20.0 110.537 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.65 123.27 17.45 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 107.738 -1.208 . . . . 20.0 107.738 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.1 t -140.03 105.83 5.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.272 0.629 . . . . 20.0 109.875 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.981 1.312 . . . . 20.0 109.345 179.855 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 N--CA 1.463 0.186 0 CA-C-O 119.351 -0.357 . . . . 20.0 111.487 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.2 m -61.92 -34.89 76.89 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.477 0.711 . . . . 20.0 111.392 176.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.29 -49.55 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.282 1.433 . . . . 20.0 110.367 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 t -63.89 -33.41 75.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.98 1.312 . . . . 20.0 112.455 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -82.4 -8.25 59.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.52 1.528 . . . . 20.0 113.104 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.29 15.32 41.69 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.558 1.075 . . . . 20.0 114.512 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -100.34 -177.57 3.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.052 1.741 . . . . 20.0 111.695 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.3 170.08 15.62 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.28 1.419 . . . . 20.0 112.525 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.6 m -113.62 78.84 1.18 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.006 1.322 . . . . 20.0 109.834 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.13 156.78 74.07 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.972 0.909 . . . . 20.0 109.491 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.05 161.65 45.19 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.771 2.314 . . . . 20.0 110.694 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -64.06 -29.92 71.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.898 0.879 . . . . 20.0 111.17 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 t -62.66 -36.15 81.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.613 1.165 . . . . 20.0 112.542 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -86.89 -58.09 2.73 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.943 0.897 . . . . 20.0 111.047 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.9 t -67.42 118.48 57.1 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.955 1.302 . . . . 20.0 110.978 -176.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -71.46 162.25 42.9 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.321 2.681 . . . . 20.0 110.845 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.52 -14.69 61.26 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.427 1.091 . . . . 20.0 113.461 -166.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.38 -34.04 65.34 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 128.226 2.61 . . . . 20.0 112.244 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.12 -6.43 38.44 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.197 1.799 . . . . 20.0 114.104 -173.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.52 105.53 3.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.079 0.951 . . . . 20.0 110.434 177.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.36 169.44 12.31 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.494 . . . . 20.0 111.808 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.3 t -93.8 -15.04 25.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.781 1.233 . . . . 20.0 112.677 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -63.57 170.61 3.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.703 1.601 . . . . 20.0 111.491 170.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -147.25 -178.65 22.69 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.134 0.874 . . . . 20.0 113.587 -176.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.66 -13.18 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.627 2.061 . . . . 20.0 113.65 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 87.8 m -69.32 176.29 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.57 1.548 . . . . 20.0 112.909 179.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.3 t -90.64 -15.68 30.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.65 0.78 . . . . 20.0 111.077 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.4 p -137.69 -74.78 0.41 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 20.0 109.65 -176.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -161.98 161.06 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.236 1.814 . . . . 20.0 108.525 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.8 m -92.29 162.55 14.24 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.435 0.694 . . . . 20.0 110.965 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -146.85 121.15 9.58 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.013 0.925 . . . . 20.0 109.378 177.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -70.79 92.74 0.91 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.944 0.897 . . . . 20.0 111.563 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -64.11 -30.26 71.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.842 1.257 . . . . 20.0 112.485 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.7 p -71.23 -7.72 48.74 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.943 1.697 . . . . 20.0 113.507 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 77.1 mttt . . . . . 0 CA--C 1.536 0.416 0 C-N-CA 125.387 1.475 . . . . 20.0 112.862 -179.683 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 113.852 1.056 . . . . 20.0 113.852 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.1 -22.37 36.9 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.612 1.577 . . . . 20.0 114.012 174.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.67 173.97 43.73 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.677 1.608 . . . . 20.0 114.183 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -138.16 169.06 18.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.144 1.378 . . . . 20.0 112.99 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 12.0 t -95.8 33.91 1.6 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.032 2.133 . . . . 20.0 112.164 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.44 156.11 44.05 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.633 1.573 . . . . 20.0 112.895 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.46 159.42 44.4 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.711 3.607 . . . . 20.0 112.08 -171.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.2 -21.14 64.88 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.019 1.328 . . . . 20.0 112.518 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.29 -25.33 66.8 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.743 1.617 . . . . 20.0 112.836 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.55 150.97 42.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.817 1.247 . . . . 20.0 110.536 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -134.02 102.47 5.43 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.906 1.282 . . . . 20.0 109.188 -179.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.39 -87.73 0.08 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.444 1.897 . . . . 20.0 107.739 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -146.57 165.82 28.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.203 1.801 . . . . 20.0 109.302 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.96 163.53 32.72 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.977 0.911 . . . . 20.0 111.238 170.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.2 tp -169.23 109.92 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 107.498 -1.297 . . . . 20.0 107.498 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -67.1 -18.93 65.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.305 1.442 . . . . 20.0 114.147 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.7 -27.7 66.67 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.005 1.113 . . . . 20.0 114.005 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -127.5 -30.56 2.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.767 1.227 . . . . 20.0 111.832 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 54.7 p -70.46 -22.65 62.66 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.894 1.072 . . . . 20.0 113.894 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.28 -6.38 6.79 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.617 1.567 . . . . 20.0 114.412 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m -126.45 67.81 1.23 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.552 1.541 . . . . 20.0 109.401 167.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.86 -27.72 2.06 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.002 1.321 . . . . 20.0 113.934 171.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.62 -92.15 0.23 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 124.836 1.207 . . . . 20.0 111.923 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -77.13 41.33 0.29 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.97 2.108 . . . . 20.0 112.828 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.72 60.07 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 C-N-CA 123.75 0.69 . . . . 20.0 113.429 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -86.03 79.76 9.07 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 123.069 1.414 . . . . 20.0 111.314 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.66 119.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 128.395 2.678 . . . . 20.0 110.031 166.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -72.72 88.37 1.29 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.056 0.455 . . . . 20.0 110.807 176.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 26.4 t -81.53 132.77 35.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.459 1.904 . . . . 20.0 110.263 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 123.523 0.729 . . . . 20.0 110.379 174.026 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 . . . . . 0 N--CA 1.462 0.145 0 CA-C-O 119.393 -0.337 . . . . 20.0 110.3 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.7 m -62.74 -36.47 83.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.708 1.203 . . . . 20.0 111.523 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.14 -43.49 95.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.508 1.523 . . . . 20.0 110.013 174.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 t -62.6 -38.41 90.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.082 0.953 . . . . 20.0 111.839 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -70.75 -30.07 66.48 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.484 1.114 . . . . 20.0 112.16 176.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.72 -2.23 23.17 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.771 1.653 . . . . 20.0 114.619 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -71.98 -179.15 2.63 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.349 1.86 . . . . 20.0 112.277 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.81 171.9 18.43 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 124.785 1.184 . . . . 20.0 113.195 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -113.2 82.35 1.65 Allowed 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.68 1.592 . . . . 20.0 109.837 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -86.64 156.04 56.12 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.408 1.083 . . . . 20.0 109.253 173.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.31 164.69 34.88 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.741 2.294 . . . . 20.0 110.809 170.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -64.52 -25.61 68.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.757 1.223 . . . . 20.0 112.013 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 t -69.59 -36.39 76.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.287 1.035 . . . . 20.0 112.124 177.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -86.62 -52.84 5.3 Favored 'General case' 0 C--N 1.344 0.349 0 C-N-CA 124.151 0.98 . . . . 20.0 111.475 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.1 t -67.2 119.33 63.93 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 124.36 1.064 . . . . 20.0 110.497 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -69.45 158.42 57.43 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.807 2.338 . . . . 20.0 110.321 175.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -73.44 -16.34 61.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.357 1.063 . . . . 20.0 112.878 -165.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.55 -40.75 48.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.597 2.359 . . . . 20.0 111.772 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.23 -4.71 51.93 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.872 1.669 . . . . 20.0 113.833 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.94 107.9 5.57 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 124.275 1.03 . . . . 20.0 110.84 -179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.04 170.65 10.95 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.911 1.684 . . . . 20.0 112.196 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 t -99.78 -11.11 21.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.571 1.548 . . . . 20.0 112.55 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -65.24 174.61 1.98 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.226 1.811 . . . . 20.0 111.306 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.92 176.75 25.64 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.669 0.652 . . . . 20.0 113.406 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.07 -12.71 17.03 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.136 1.826 . . . . 20.0 113.862 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -69.01 175.86 3.49 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.725 1.262 . . . . 20.0 112.323 173.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.6 p -85.07 -22.85 28.8 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 124.529 1.132 . . . . 20.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 p -140.9 -67.71 0.41 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.086 1.354 . . . . 20.0 110.297 -170.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.7 147.47 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 125.179 1.392 . . . . 20.0 109.862 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.9 m -87.32 131.02 34.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.741 1.216 . . . . 20.0 110.129 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 t -124.6 127.55 47.54 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.517 1.127 . . . . 20.0 109.701 -174.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -76.75 80.95 3.36 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.903 0.881 . . . . 20.0 113.3 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.62 -26.82 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.531 1.532 . . . . 20.0 113.95 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.6 m -67.3 -18.68 65.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.347 1.059 . . . . 20.0 113.048 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 pttt . . . . . 0 CA--C 1.533 0.323 0 C-N-CA 125.78 1.632 . . . . 20.0 113.545 -176.32 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.1 mttt . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 113.779 1.029 . . . . 20.0 113.779 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 137.61 20.3 0.55 Allowed Glycine 0 CA--C 1.53 0.998 0 CA-C-O 118.805 -0.997 . . . . 20.0 114.185 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.61 -161.19 3.68 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.536 1.541 . . . . 20.0 113.986 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -139.82 140.62 36.65 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.153 1.381 . . . . 20.0 110.593 -172.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.43 122.25 32.45 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.559 0.744 . . . . 20.0 109.956 165.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -137.45 154.97 75.68 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.81 2.044 . . . . 20.0 110.035 173.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.81 164.99 19.76 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.724 3.616 . . . . 20.0 114.409 -165.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.23 -15.04 30.53 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.163 1.385 . . . . 20.0 113.834 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -88.91 -6.55 57.22 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.425 1.49 . . . . 20.0 113.922 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -67.28 -22.26 65.66 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.588 1.155 . . . . 20.0 114.107 -170.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 67.06 1.8 2.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.458 1.903 . . . . 20.0 114.525 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -63.58 -87.83 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.26 1.824 . . . . 20.0 112.207 -175.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -153.79 161.45 42.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.634 1.974 . . . . 20.0 109.121 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -128.24 141.23 51.52 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.781 2.032 . . . . 20.0 109.684 176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 68.0 mt -139.7 105.22 5.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.518 1.927 . . . . 20.0 108.889 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -63.54 -20.85 65.96 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.822 1.192 . . . . 20.0 113.46 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.06 -15.96 60.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.814 1.246 . . . . 20.0 113.983 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -129.83 -44.88 1.18 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.712 1.205 . . . . 20.0 112.138 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 m -66.47 -28.98 69.01 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 125.202 1.401 . . . . 20.0 113.228 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.11 -14.97 58.53 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.4 . . . . 20.0 112.992 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.4 m -68.44 -51.02 48.26 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 125.533 1.533 . . . . 20.0 111.616 173.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 23.3 m -69.1 -26.75 65.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.922 0.889 . . . . 20.0 111.517 169.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.24 -179.06 19.36 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.729 1.633 . . . . 20.0 113.278 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.33 45.3 0.37 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.282 2.633 . . . . 20.0 113.194 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -143.49 -2.72 0.91 Allowed Glycine 0 CA--C 1.535 1.311 0 C-N-CA 126.972 2.225 . . . . 20.0 113.018 176.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -135.87 171.21 14.79 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.048 1.424 . . . . 20.0 111.297 176.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -144.34 120.44 10.77 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.308 2.243 . . . . 20.0 110.509 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -81.09 125.49 30.28 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.262 1.425 . . . . 20.0 112.027 -165.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 35.8 m -71.99 -12.58 61.3 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 115.006 1.484 . . . . 20.0 115.006 -179.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 124.454 1.101 . . . . 20.0 112.069 -173.91 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.593 0.59 . . . . 20.0 112.593 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -63.79 -33.9 76.7 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.993 . . . . 20.0 111.754 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -42.6 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 125.274 1.43 . . . . 20.0 110.843 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 t -59.52 -45.03 92.93 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.864 1.666 . . . . 20.0 111.889 -177.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -69.06 -13.06 62.22 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.808 1.243 . . . . 20.0 113.443 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.28 5.75 57.95 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 125.4 1.476 . . . . 20.0 114.036 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -81.01 177.29 9.15 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.271 1.028 . . . . 20.0 112.011 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.97 177.05 18.0 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.235 1.398 . . . . 20.0 112.222 -174.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.4 m -131.24 71.91 1.49 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.922 1.289 . . . . 20.0 110.27 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.87 159.21 83.52 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.832 1.253 . . . . 20.0 109.696 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.73 161.04 47.48 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.391 2.061 . . . . 20.0 110.65 172.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.61 -21.47 66.72 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.0 0.92 . . . . 20.0 111.779 176.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.4 m -71.01 -17.98 62.61 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.541 1.536 . . . . 20.0 114.167 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.76 -46.12 2.66 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.558 1.143 . . . . 20.0 111.319 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.4 t -66.61 119.03 59.93 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 123.53 0.732 . . . . 20.0 110.537 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -71.33 161.25 46.29 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.327 2.684 . . . . 20.0 110.477 175.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -76.12 -13.5 60.2 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.416 0.895 . . . . 20.0 113.416 -166.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.07 -42.76 62.72 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.701 2.4 . . . . 20.0 111.794 171.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.72 -9.46 59.43 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.231 1.413 . . . . 20.0 113.482 -175.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.68 102.77 2.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.805 1.242 . . . . 20.0 111.33 -177.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 mt -75.57 167.12 22.5 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.872 1.269 . . . . 20.0 112.166 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -87.67 -12.14 46.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 20.0 112.773 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.89 170.39 11.26 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.744 1.217 . . . . 20.0 111.912 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.12 177.76 17.23 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.113 1.34 . . . . 20.0 112.669 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.03 -8.63 25.23 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.854 1.692 . . . . 20.0 113.53 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.0 m -77.52 175.83 9.47 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.555 1.142 . . . . 20.0 112.42 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -114.2 -5.06 13.02 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.317 1.447 . . . . 20.0 111.99 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.8 p -137.33 -71.83 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.998 1.719 . . . . 20.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -163.65 153.18 2.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.084 1.754 . . . . 20.0 109.42 177.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.94 157.32 38.38 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.853 0.861 . . . . 20.0 111.823 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -153.29 119.1 5.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.009 0.924 . . . . 20.0 110.185 174.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -71.76 90.51 1.09 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.017 0.927 . . . . 20.0 112.587 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.93 -37.61 82.91 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.66 1.184 . . . . 20.0 112.681 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.2 p -73.84 -5.54 41.56 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.872 1.269 . . . . 20.0 113.774 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mtmt . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.505 1.522 . . . . 20.0 113.116 179.972 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 118.934 -0.555 . . . . 20.0 111.518 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.13 68.54 1.46 Allowed Glycine 0 C--N 1.343 0.936 0 N-CA-C 109.788 -1.325 . . . . 20.0 109.788 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.88 165.26 48.64 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.142 0.877 . . . . 20.0 113.645 -174.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.54 168.23 13.88 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.56 1.144 . . . . 20.0 111.541 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 69.7 m -112.55 107.83 16.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.29 1.036 . . . . 20.0 110.27 175.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -129.09 159.14 70.39 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.953 2.101 . . . . 20.0 109.411 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.48 170.86 15.26 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.088 2.525 . . . . 20.0 113.07 -171.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.2 mt -54.14 -35.9 62.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.727 1.211 . . . . 20.0 112.479 169.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -79.84 4.89 15.16 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.81 1.644 . . . . 20.0 113.665 -175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -64.3 -13.23 48.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.186 1.394 . . . . 20.0 113.573 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? 72.29 2.69 4.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.048 2.139 . . . . 20.0 112.976 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 165.92 3.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.313 1.845 . . . . 20.0 111.064 167.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -139.44 92.1 2.55 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 123.922 0.889 . . . . 20.0 110.682 -172.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.423 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.1 tp10 -154.88 -173.49 4.59 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.39 1.476 . . . . 20.0 110.058 174.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.423 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.0 pp -55.98 152.58 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.184 1.394 . . . . 20.0 113.02 175.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -131.64 2.46 4.11 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.641 1.176 . . . . 20.0 112.381 -171.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.09 -78.33 0.18 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.139 1.376 . . . . 20.0 110.916 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -68.77 -33.11 73.34 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.885 1.274 . . . . 20.0 112.437 -175.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.1 m -62.16 -31.16 71.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.116 1.366 . . . . 20.0 112.251 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.5 -9.74 37.64 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 114.866 1.432 . . . . 20.0 114.866 -172.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.9 t -58.34 -16.7 15.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.682 1.593 . . . . 20.0 114.181 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -17.55 53.24 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.19 1.182 . . . . 20.0 114.19 -176.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 138.71 -81.02 0.27 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.027 0.822 . . . . 20.0 112.755 171.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.48 59.82 3.05 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.051 1.74 . . . . 20.0 111.965 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 48.93 23.95 4.0 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 129.863 3.601 . . . . 20.0 114.931 -176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -41.69 146.02 0.27 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 128.213 2.605 . . . . 20.0 112.715 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -135.46 133.38 38.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.552 -1.204 . . . . 20.0 109.704 -177.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.45 131.93 29.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 124.314 1.009 . . . . 20.0 110.961 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.9 t -138.9 20.93 2.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.993 1.317 . . . . 20.0 111.525 -171.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 125.044 1.338 . . . . 20.0 109.776 170.786 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 112.999 0.74 . . . . 20.0 112.999 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.7 m -58.05 -52.48 65.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.033 0.933 . . . . 20.0 110.902 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.38 -36.23 77.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.956 1.702 . . . . 20.0 111.414 -176.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 t -64.84 -35.97 82.83 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.674 1.189 . . . . 20.0 111.99 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -77.78 -18.13 56.76 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.543 0.737 . . . . 20.0 111.895 174.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.19 -7.67 35.21 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 126.598 2.047 . . . . 20.0 113.144 177.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -70.4 174.74 5.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.94 1.696 . . . . 20.0 112.279 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.71 -176.5 14.46 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.996 1.284 . . . . 20.0 112.604 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.1 m -125.74 58.55 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.414 1.485 . . . . 20.0 110.758 -173.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.83 156.42 87.11 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 125.035 1.334 . . . . 20.0 110.015 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -70.9 162.73 41.63 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.595 2.197 . . . . 20.0 110.875 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -65.6 -16.62 63.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.572 0.749 . . . . 20.0 111.962 173.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.9 m -72.84 -28.61 62.64 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.506 1.522 . . . . 20.0 113.067 173.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -107.59 -47.87 3.54 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.533 1.133 . . . . 20.0 111.24 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.2 t -65.94 121.04 73.96 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.909 1.284 . . . . 20.0 109.776 172.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.81 170.18 18.45 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.54 2.827 . . . . 20.0 110.499 174.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -77.94 -10.73 59.73 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.658 0.985 . . . . 20.0 113.658 -171.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.34 -37.46 19.89 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.89 2.076 . . . . 20.0 112.316 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 -2.85 43.12 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.35 1.86 . . . . 20.0 113.657 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.94 97.97 4.12 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 124.571 1.148 . . . . 20.0 110.997 -174.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.89 168.34 13.78 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.967 1.707 . . . . 20.0 111.402 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -85.45 -15.26 43.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.626 1.17 . . . . 20.0 112.971 -177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -66.37 167.67 10.14 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.431 1.492 . . . . 20.0 112.056 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.49 178.44 19.98 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.873 1.225 . . . . 20.0 112.265 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.88 -11.73 29.65 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 125.47 1.509 . . . . 20.0 113.02 -176.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.3 m -67.16 176.33 2.23 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.367 1.467 . . . . 20.0 112.537 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.7 t -101.14 -12.43 18.79 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.722 1.209 . . . . 20.0 111.736 174.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -139.64 -74.04 0.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.939 1.696 . . . . 20.0 109.807 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -163.89 143.42 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 125.047 1.339 . . . . 20.0 109.802 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.7 t -74.26 139.52 44.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.137 0.975 . . . . 20.0 109.704 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -138.3 124.81 20.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.641 0.776 . . . . 20.0 110.712 -175.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -73.09 82.06 1.27 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.046 0.939 . . . . 20.0 112.45 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.44 -31.67 72.89 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.747 1.219 . . . . 20.0 113.134 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -71.85 -11.98 61.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.572 1.149 . . . . 20.0 112.832 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.6 mttm . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 125.8 1.64 . . . . 20.0 112.957 -178.579 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.1 ttpt . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 114.916 1.45 . . . . 20.0 114.916 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 -11.98 70.15 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 126.25 1.881 . . . . 20.0 112.865 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.5 108.66 0.07 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.212 1.863 . . . . 20.0 113.389 174.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.37 179.21 5.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.549 1.14 . . . . 20.0 111.021 168.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.4 t -137.55 57.34 1.74 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.166 0.986 . . . . 20.0 110.686 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.4 159.25 74.07 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.956 1.702 . . . . 20.0 112.08 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.07 164.12 31.32 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.524 2.816 . . . . 20.0 113.117 -176.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.27 -16.23 64.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.855 0.862 . . . . 20.0 112.607 172.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -65.87 -25.63 67.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.176 1.39 . . . . 20.0 112.763 172.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -68.96 148.62 49.88 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.923 0.889 . . . . 20.0 111.089 -175.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.33 9.1 24.45 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.286 1.034 . . . . 20.0 113.272 -178.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.4 t -60.24 169.23 1.69 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.166 1.386 . . . . 20.0 112.011 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -146.39 114.57 6.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.696 1.998 . . . . 20.0 108.354 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -152.96 176.18 12.14 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.291 0.567 . . . . 20.0 112.129 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.422 HD13 ' H ' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -58.05 140.45 52.49 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.839 1.656 . . . . 20.0 112.847 174.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -75.32 -9.9 58.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.363 1.865 . . . . 20.0 114.235 174.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.29 -71.91 0.28 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.968 0.907 . . . . 20.0 110.858 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.422 ' H ' HD13 ' A' ' 57' ' ' LEU . 3.8 mm-40 -65.97 -28.11 68.65 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.114 1.366 . . . . 20.0 113.056 -178.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -66.6 -41.51 88.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.351 0.5 . . . . 20.0 112.351 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.14 -19.74 63.2 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.733 0.813 . . . . 20.0 112.212 174.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.2 m -90.74 -17.27 26.98 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.386 1.474 . . . . 20.0 112.86 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.98 -45.27 74.63 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 125.058 1.343 . . . . 20.0 110.241 176.303 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 142.33 175.4 15.59 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.292 0.948 . . . . 20.0 113.035 170.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -79.54 73.89 6.21 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.918 1.287 . . . . 20.0 109.204 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 162.32 -18.1 0.16 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.042 1.306 . . . . 20.0 113.127 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -146.57 174.42 11.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.534 1.533 . . . . 20.0 112.288 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -157.06 162.94 39.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.011 1.724 . . . . 20.0 112.122 -171.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -69.05 153.06 44.41 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 118.213 0.461 . . . . 20.0 110.481 169.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.9 t -152.56 159.07 43.3 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.384 1.474 . . . . 20.0 109.886 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.546 0.797 0 C-N-CA 127.104 2.161 . . . . 20.0 107.53 175.187 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 111.318 0.118 . . . . 20.0 111.318 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.0 t -65.28 -41.4 94.21 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.337 1.455 . . . . 20.0 112.098 -177.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 73.4 t -77.0 -40.18 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 20.0 110.822 176.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.9 t -62.46 -36.27 81.93 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.781 1.232 . . . . 20.0 112.628 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -76.04 -6.43 51.03 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 20.0 113.341 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.37 25.4 21.42 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.799 -1.001 . . . . 20.0 113.977 171.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -111.13 174.62 5.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.542 1.137 . . . . 20.0 111.594 -177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.79 178.03 16.57 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.033 1.302 . . . . 20.0 113.063 -171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.9 m -123.51 69.33 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.242 1.417 . . . . 20.0 109.96 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mp -71.82 155.47 92.12 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 124.715 1.206 . . . . 20.0 109.29 171.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -72.01 162.01 43.1 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.162 2.575 . . . . 20.0 110.632 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -65.08 -24.38 67.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.209 0.604 . . . . 20.0 112.14 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -63.11 -39.43 94.68 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.689 1.196 . . . . 20.0 112.016 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -96.86 -47.8 5.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.412 1.085 . . . . 20.0 111.768 -176.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.13 118.12 36.42 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.36 1.464 . . . . 20.0 110.771 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -70.06 158.0 57.97 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.736 2.291 . . . . 20.0 110.355 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -77.84 -9.95 59.31 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.296 1.039 . . . . 20.0 112.708 -167.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.88 -37.71 39.5 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.306 2.242 . . . . 20.0 112.014 172.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.21 -5.05 55.46 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.413 1.485 . . . . 20.0 113.85 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -74.71 100.86 4.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.877 0.871 . . . . 20.0 111.523 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.6 mt -70.88 175.46 5.05 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.594 1.958 . . . . 20.0 112.605 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.4 p -99.75 -6.45 27.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.481 1.112 . . . . 20.0 113.56 177.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -72.34 172.83 9.64 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.328 1.051 . . . . 20.0 111.91 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.88 170.66 22.38 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.075 1.322 . . . . 20.0 111.684 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.54 12.41 3.39 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.176 1.369 . . . . 20.0 113.881 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 89.8 m -108.47 176.28 5.17 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 125.473 1.509 . . . . 20.0 111.856 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.1 m -110.31 -4.0 15.9 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.768 1.227 . . . . 20.0 111.912 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 p -137.16 -72.19 0.43 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.069 1.748 . . . . 20.0 109.634 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -160.12 143.24 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 124.681 1.193 . . . . 20.0 110.23 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.4 m -73.57 129.29 37.66 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 124.573 1.149 . . . . 20.0 110.245 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.3 t -131.11 113.55 14.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.434 1.094 . . . . 20.0 110.901 -174.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -63.52 108.24 1.32 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.992 2.117 . . . . 20.0 110.921 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.2 mt -83.04 -18.97 37.84 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.77 1.228 . . . . 20.0 113.272 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.5 p -78.75 -12.1 60.01 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.634 0.976 . . . . 20.0 113.634 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 C-N-CA 126.053 1.741 . . . . 20.0 112.813 171.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 tttm . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 114.459 1.281 . . . . 20.0 114.459 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.33 1.9 47.62 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.293 1.901 . . . . 20.0 112.916 -171.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.29 169.76 39.5 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 125.708 1.623 . . . . 20.0 114.201 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -153.54 -179.4 7.74 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.077 1.14 . . . . 20.0 114.077 -169.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.0 m -113.1 82.26 1.63 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.917 2.087 . . . . 20.0 109.981 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.8 165.88 29.94 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 125.204 1.402 . . . . 20.0 111.438 173.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -67.66 150.98 79.73 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.833 3.022 . . . . 20.0 112.807 -176.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.8 mt -63.96 -19.25 65.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.81 1.244 . . . . 20.0 112.409 171.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.34 -24.2 65.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.564 1.545 . . . . 20.0 111.928 174.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -84.71 128.35 34.56 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.282 1.033 . . . . 20.0 110.243 175.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -67.87 107.45 2.64 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.715 1.606 . . . . 20.0 111.276 -175.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.1 t -156.93 -170.26 3.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.273 1.829 . . . . 20.0 109.727 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -120.15 174.81 6.26 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.473 1.909 . . . . 20.0 109.995 175.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -136.27 161.38 35.92 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.505 1.522 . . . . 20.0 111.742 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -137.18 22.47 3.01 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.994 1.718 . . . . 20.0 114.439 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . 0.254 23.1 pt20 53.92 21.45 2.83 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 130.366 3.466 . . . . 20.0 116.912 166.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.75 -87.1 0.64 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.568 1.547 . . . . 20.0 109.977 -170.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -75.45 -27.05 58.76 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.577 0.626 . . . . 20.0 110.928 174.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.6 p -71.42 11.93 0.4 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.73 2.012 . . . . 20.0 113.877 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.04 -9.81 8.68 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.909 1.684 . . . . 20.0 112.775 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 t -86.33 -46.85 9.9 Favored 'General case' 0 C--N 1.345 0.395 0 C-N-CA 124.399 1.08 . . . . 20.0 113.122 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 5.0 m -66.54 -8.7 28.48 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.596 1.559 . . . . 20.0 115.083 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.27 164.76 33.17 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.755 1.645 . . . . 20.0 112.778 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -48.34 117.7 2.09 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.273 1.429 . . . . 20.0 112.087 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.07 8.4 11.66 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-O 118.248 -1.307 . . . . 20.0 113.009 -171.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.5 pm0 -105.36 153.49 21.58 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.467 1.634 . . . . 20.0 112.622 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 166.52 33.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.955 2.102 . . . . 20.0 109.486 162.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.6 t -128.09 133.69 49.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.072 0.949 . . . . 20.0 111.045 -175.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 82.6 m -133.81 77.89 1.74 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.331 1.452 . . . . 20.0 109.638 -168.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.462 0.167 0 C-N-CA 123.901 0.881 . . . . 20.0 108.81 -172.663 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 119.505 -0.283 . . . . 20.0 111.472 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.34 -56.33 23.51 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.964 1.306 . . . . 20.0 111.205 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.1 t -72.36 -28.25 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 125.643 1.577 . . . . 20.0 111.006 -178.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.3 t -66.72 -38.31 86.45 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.308 1.043 . . . . 20.0 111.685 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -75.05 -10.54 59.57 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.566 1.146 . . . . 20.0 112.886 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.71 1.16 62.01 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.841 1.21 . . . . 20.0 114.817 172.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -73.01 175.26 6.82 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.423 1.112 . . . . 20.0 111.561 175.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -106.32 166.91 13.97 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 124.873 1.225 . . . . 20.0 112.226 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -118.71 69.17 0.8 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.245 1.418 . . . . 20.0 109.202 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.18 156.18 90.9 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.99 1.316 . . . . 20.0 109.69 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.48 161.77 44.6 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.658 2.239 . . . . 20.0 111.215 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -63.54 -24.61 67.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.031 0.932 . . . . 20.0 112.148 177.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 p -65.99 -46.56 77.55 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.836 1.254 . . . . 20.0 111.982 173.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -80.77 -52.58 7.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.553 1.141 . . . . 20.0 111.558 -176.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.4 t -67.94 120.35 73.35 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.903 1.281 . . . . 20.0 110.657 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -69.31 161.49 45.66 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.316 2.677 . . . . 20.0 110.845 175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.71 -21.08 62.6 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.008 1.323 . . . . 20.0 112.696 -166.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.22 -39.46 59.98 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.877 2.471 . . . . 20.0 112.113 176.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.08 -5.21 55.48 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.083 1.353 . . . . 20.0 113.415 -177.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.98 102.39 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 124.291 1.036 . . . . 20.0 110.646 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.41 170.19 14.77 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.53 1.132 . . . . 20.0 111.983 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -91.91 -9.69 42.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.286 1.434 . . . . 20.0 112.698 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -71.41 159.88 33.75 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.693 1.197 . . . . 20.0 112.358 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -112.8 -179.5 19.49 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.7 1.619 . . . . 20.0 112.802 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.43 -5.75 41.4 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.382 1.467 . . . . 20.0 114.071 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.5 m -82.44 178.32 8.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.925 1.29 . . . . 20.0 112.524 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -114.57 -2.35 13.15 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.539 1.536 . . . . 20.0 111.649 175.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.8 p -138.64 -74.25 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.225 1.81 . . . . 20.0 109.841 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -166.74 143.61 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 126.526 1.93 . . . . 20.0 108.967 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.05 145.08 40.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.48 0.712 . . . . 20.0 110.265 173.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.09 118.66 14.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.854 0.861 . . . . 20.0 110.304 -176.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 93.13 0.33 Allowed 'General case' 0 C--N 1.346 0.417 0 C-N-CA 123.793 0.837 . . . . 20.0 111.665 178.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.31 -28.22 67.81 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.494 0.717 . . . . 20.0 111.65 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 t -78.38 -11.74 59.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.496 1.518 . . . . 20.0 113.226 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.7 mttp . . . . . 0 N--CA 1.467 0.418 0 C-N-CA 124.806 1.242 . . . . 20.0 113.465 -176.327 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 114.736 1.384 . . . . 20.0 114.736 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 6.96 66.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.029 1.776 . . . . 20.0 113.712 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.43 -161.05 4.36 Favored Glycine 0 C--N 1.343 0.947 0 C-N-CA 126.618 2.056 . . . . 20.0 114.021 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -130.53 171.45 13.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 122.95 0.5 . . . . 20.0 112.272 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.2 t -98.57 107.58 20.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.96 0.904 . . . . 20.0 110.421 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -137.21 156.51 75.38 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.878 2.471 . . . . 20.0 109.518 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.69 164.69 30.29 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.593 2.862 . . . . 20.0 113.494 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.55 -21.14 64.01 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.682 1.593 . . . . 20.0 112.702 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -98.8 9.9 42.41 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.843 1.657 . . . . 20.0 113.337 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.4 tpt85 -74.78 33.13 0.09 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.442 1.897 . . . . 20.0 112.985 175.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.28 -8.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 129.568 3.147 . . . . 20.0 114.459 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 59.3 m -74.29 148.84 41.07 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.554 1.542 . . . . 20.0 111.274 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -150.26 116.25 5.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.352 1.461 . . . . 20.0 110.493 173.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.444 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 5.3 tp10 -160.26 -173.97 4.29 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.328 1.451 . . . . 20.0 109.97 178.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.444 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.0 pp -56.94 158.47 4.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.252 1.821 . . . . 20.0 113.061 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -121.17 -0.52 9.93 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.931 2.092 . . . . 20.0 113.692 174.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.92 -9.56 39.48 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.748 1.619 . . . . 20.0 114.623 176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -135.07 -42.66 0.73 Allowed 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.208 1.403 . . . . 20.0 111.44 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.2 p -63.43 -16.45 60.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.356 1.462 . . . . 20.0 113.907 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.81 -2.3 0.53 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.011 2.124 . . . . 20.0 114.009 171.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m -56.97 -39.73 75.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.2 1.8 . . . . 20.0 112.748 172.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.5 t -76.46 -15.76 59.83 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 119.058 0.845 . . . . 20.0 112.684 173.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.45 -175.54 21.88 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 126.099 1.809 . . . . 20.0 111.365 -171.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -65.47 99.86 0.45 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.567 1.547 . . . . 20.0 109.642 175.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.07 -24.85 0.61 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.182 1.372 . . . . 20.0 112.832 -175.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -105.08 138.51 41.17 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.993 1.397 . . . . 20.0 111.672 -175.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.48 138.64 46.25 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.838 2.455 . . . . 20.0 110.746 175.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.0 t -55.6 110.76 0.76 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.544 1.138 . . . . 20.0 111.428 -177.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.9 t -138.92 72.38 1.4 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 123.415 0.686 . . . . 20.0 112.348 -169.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.338 0.1 0 C-N-CA 124.749 1.22 . . . . 20.0 109.42 -178.971 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 110.443 -0.206 . . . . 20.0 110.443 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -100.44 -45.22 5.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.149 0.979 . . . . 20.0 110.802 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 79.8 m -65.25 -26.2 68.0 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.631 1.173 . . . . 20.0 112.996 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.1 t -65.02 -52.77 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.057 1.343 . . . . 20.0 109.905 167.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 t -63.28 -30.84 71.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.866 1.266 . . . . 20.0 112.94 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.66 -31.22 21.19 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.782 1.233 . . . . 20.0 111.942 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.25 58.88 1.19 Allowed Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.202 1.382 . . . . 20.0 113.324 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -127.44 -178.76 4.58 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.001 2.12 . . . . 20.0 111.25 174.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.91 178.83 32.4 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.27 1.414 . . . . 20.0 113.037 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.5 m -128.37 30.3 5.2 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.545 1.938 . . . . 20.0 112.239 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.6 148.11 67.67 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.111 0.965 . . . . 20.0 110.825 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.93 164.08 36.8 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.136 2.557 . . . . 20.0 111.841 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -60.07 -29.6 68.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.059 1.743 . . . . 20.0 112.221 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.0 m -72.71 -35.19 67.53 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.179 0.992 . . . . 20.0 112.602 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -81.21 -65.65 0.99 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.14 0.976 . . . . 20.0 110.405 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 m -70.51 154.3 94.5 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 123.697 0.799 . . . . 20.0 111.359 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.24 173.39 14.59 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.694 2.929 . . . . 20.0 111.719 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.42 -18.56 61.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.065 1.346 . . . . 20.0 113.037 -174.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -90.7 -36.54 14.27 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.958 2.103 . . . . 20.0 112.877 -175.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.45 -9.74 57.27 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.505 1.522 . . . . 20.0 113.658 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.12 101.46 1.44 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.661 1.585 . . . . 20.0 110.702 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -72.22 164.02 26.96 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.672 1.189 . . . . 20.0 111.106 175.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.9 m -94.39 -11.35 30.08 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.084 1.353 . . . . 20.0 113.172 -175.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -64.88 168.58 6.15 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.67 1.988 . . . . 20.0 112.278 177.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -123.89 -178.6 15.46 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.889 1.233 . . . . 20.0 113.935 -175.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.93 -16.47 54.3 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.833 2.159 . . . . 20.0 114.444 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.1 m -73.07 -178.63 2.92 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.778 1.231 . . . . 20.0 112.65 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -94.7 -18.0 21.71 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.676 0.79 . . . . 20.0 111.958 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 p -142.1 -73.02 0.31 Allowed 'General case' 0 C--N 1.34 0.177 0 C-N-CA 125.455 1.502 . . . . 20.0 109.454 -173.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.51 148.64 11.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.574 1.549 . . . . 20.0 108.208 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.9 m -84.62 145.68 27.89 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.735 0.414 . . . . 20.0 110.217 173.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 45.2 t -134.49 120.87 20.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.557 1.143 . . . . 20.0 110.124 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.34 88.43 0.64 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.69 1.196 . . . . 20.0 112.747 -178.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.5 mt -66.1 -22.14 66.39 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.555 1.142 . . . . 20.0 112.571 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.1 m -65.68 -22.08 66.6 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 125.812 1.645 . . . . 20.0 112.6 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -127.35 4.81 6.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.595 1.558 . . . . 20.0 112.569 -170.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.54 -41.91 14.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.061 1.744 . . . . 20.0 111.071 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.6 p -98.57 -80.55 0.46 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.563 1.545 . . . . 20.0 110.899 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.71 -127.26 1.67 Allowed Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.5 1.048 . . . . 20.0 111.124 -175.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.05 83.66 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.957 1.303 . . . . 20.0 111.629 -178.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -62.42 -24.62 67.51 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.145 1.778 . . . . 20.0 113.502 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.75 -35.47 67.86 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.313 1.435 . . . . 20.0 114.319 -172.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -121.42 -20.43 6.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.801 1.64 . . . . 20.0 112.692 171.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 141.77 -38.71 1.47 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 124.338 0.971 . . . . 20.0 112.365 167.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 170.64 46.66 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.333 0.968 . . . . 20.0 113.797 171.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -153.59 129.09 9.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.925 1.29 . . . . 20.0 110.369 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.6 m -87.99 128.75 35.39 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.362 1.065 . . . . 20.0 109.121 162.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.35 159.15 73.0 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 126.016 1.727 . . . . 20.0 109.124 168.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.15 160.3 38.94 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.841 3.027 . . . . 20.0 112.723 -170.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.32 -20.64 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.243 1.017 . . . . 20.0 112.362 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -28.29 65.52 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.917 1.687 . . . . 20.0 111.772 175.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.9 ttm-85 -99.45 111.64 23.96 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.448 1.099 . . . . 20.0 110.04 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -73.98 116.31 14.46 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.331 1.453 . . . . 20.0 109.346 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 45.8 t -144.59 -91.54 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.666 1.187 . . . . 20.0 110.276 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.422 ' HE3' ' HA ' ' A' ' 71' ' ' CYS . 22.2 ttpp -154.06 158.24 40.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.229 1.812 . . . . 20.0 109.646 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -131.68 133.08 44.49 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.841 1.256 . . . . 20.0 110.278 -176.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 tp -159.18 103.59 1.65 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.013 1.325 . . . . 20.0 110.144 -171.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -66.27 -6.69 14.73 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.96 1.704 . . . . 20.0 115.061 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.95 78.99 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.324 1.05 . . . . 20.0 113.473 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -137.24 -49.42 0.61 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.282 1.033 . . . . 20.0 111.337 -169.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.5 p -67.82 -10.23 51.12 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.106 1.151 . . . . 20.0 114.106 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.44 -20.57 46.04 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.617 1.339 . . . . 20.0 114.617 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 90.7 p -125.13 34.59 4.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.836 1.254 . . . . 20.0 112.135 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.4 -13.8 59.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.633 0.975 . . . . 20.0 113.633 174.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.15 -103.23 0.89 Allowed Glycine 0 C--N 1.343 0.958 0 C-N-CA 125.349 1.452 . . . . 20.0 110.573 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -70.31 93.72 0.88 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.244 1.417 . . . . 20.0 109.474 173.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.406 ' C ' ' H ' ' A' ' 69' ' ' LYS . . . 94.88 60.18 1.09 Allowed Glycine 0 C--N 1.337 0.617 0 C-N-CA 124.502 1.049 . . . . 20.0 112.614 175.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -75.1 36.4 0.11 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.935 2.494 . . . . 20.0 114.858 177.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' H ' ' C ' ' A' ' 67' ' ' GLY . 72.0 mmtt -119.75 99.46 6.66 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.664 1.986 . . . . 20.0 111.703 178.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.31 125.75 28.53 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.443 1.497 . . . . 20.0 110.962 173.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.422 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 80.5 m -127.5 135.66 50.68 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.828 1.651 . . . . 20.0 109.867 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.6 p -150.86 150.51 13.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.886 1.274 . . . . 20.0 108.993 175.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -135.51 -176.95 4.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.315 1.846 . . . . 20.0 110.514 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.67 -45.85 90.91 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.722 1.209 . . . . 20.0 110.979 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 72.1 m80 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 116.654 -1.641 . . . . 20.0 111.911 173.9 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 109.472 -0.566 . . . . 20.0 109.472 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -63.76 -31.76 73.04 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.627 1.171 . . . . 20.0 112.58 -175.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.0 m -53.58 -59.86 4.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.9 1.68 . . . . 20.0 110.946 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.8 t -64.3 -34.26 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 125.699 1.6 . . . . 20.0 111.387 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -68.78 -16.96 63.95 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.901 1.28 . . . . 20.0 112.925 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -102.29 -7.71 21.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.121 1.768 . . . . 20.0 112.139 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.7 0.08 52.61 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.335 1.922 . . . . 20.0 114.133 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -86.32 177.09 7.58 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.042 1.737 . . . . 20.0 111.131 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.97 -176.54 16.42 Favored Glycine 0 C--N 1.341 0.81 0 C-N-CA 124.851 1.215 . . . . 20.0 113.229 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.31 76.57 1.73 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.795 1.638 . . . . 20.0 109.304 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.09 162.02 75.81 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 125.103 1.361 . . . . 20.0 109.627 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.23 161.76 44.82 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.48 2.12 . . . . 20.0 110.457 170.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.73 -26.92 68.93 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.964 0.906 . . . . 20.0 111.469 171.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.4 m -69.73 -16.31 63.3 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.045 1.338 . . . . 20.0 113.582 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -122.34 -41.83 2.39 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.828 1.251 . . . . 20.0 111.825 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.6 t -67.63 119.46 66.11 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 123.878 0.871 . . . . 20.0 109.883 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.91 163.14 38.66 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.175 2.583 . . . . 20.0 111.276 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -72.32 -3.56 24.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.788 1.635 . . . . 20.0 113.268 -170.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -100.27 -36.51 9.25 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.248 2.619 . . . . 20.0 111.846 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.51 -13.6 59.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.167 1.387 . . . . 20.0 113.589 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -67.02 120.87 14.37 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.888 1.275 . . . . 20.0 110.852 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.4 mt -86.81 178.83 6.88 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.855 1.262 . . . . 20.0 110.829 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -102.22 -1.31 31.53 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.242 1.417 . . . . 20.0 112.688 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -68.02 174.9 3.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.968 1.707 . . . . 20.0 113.398 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.24 -176.77 14.57 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.92 1.724 . . . . 20.0 112.812 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.89 -11.79 59.08 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 126.148 1.832 . . . . 20.0 113.422 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 71.2 m -74.0 175.86 7.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.504 1.152 . . . . 20.0 112.78 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.7 m -106.27 -14.72 15.04 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.917 1.287 . . . . 20.0 111.938 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.2 p -138.01 -69.71 0.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.046 1.738 . . . . 20.0 109.985 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -157.12 156.11 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 125.35 1.46 . . . . 20.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -79.47 161.46 26.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.979 0.912 . . . . 20.0 110.338 171.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -151.35 117.56 5.61 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.638 0.775 . . . . 20.0 110.793 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -70.75 98.77 1.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.643 1.577 . . . . 20.0 110.405 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.3 mt -79.59 -16.46 55.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.402 1.081 . . . . 20.0 113.19 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -71.11 -33.19 69.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.37 1.068 . . . . 20.0 111.455 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -100.59 8.69 43.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.117 1.367 . . . . 20.0 112.959 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.6 tp -100.74 -39.54 7.78 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 126.077 1.751 . . . . 20.0 111.493 -178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.1 p -101.58 -97.92 0.27 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.01 1.324 . . . . 20.0 111.138 -175.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.34 -99.44 0.18 Allowed Glycine 0 C--N 1.343 0.96 0 CA-C-N 118.997 0.817 . . . . 20.0 111.978 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -69.21 -23.21 63.87 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.308 1.043 . . . . 20.0 112.352 176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 34.2 tttp 63.9 13.45 7.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.685 1.994 . . . . 20.0 113.881 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.97 -153.42 30.23 Favored Glycine 0 CA--C 1.533 1.219 0 C-N-CA 126.108 1.813 . . . . 20.0 112.179 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -62.99 -25.36 68.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 20.0 112.576 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 166.77 -35.2 0.23 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.617 1.103 . . . . 20.0 112.944 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.13 166.84 15.09 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 125.248 1.404 . . . . 20.0 113.99 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -151.03 167.49 27.5 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.767 1.227 . . . . 20.0 112.68 -172.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.8 m -87.23 66.14 9.1 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.421 1.488 . . . . 20.0 110.848 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.75 158.45 87.77 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.252 1.021 . . . . 20.0 111.177 172.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.86 156.22 66.78 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 124.066 3.177 . . . . 20.0 112.092 -173.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.16 -20.63 65.58 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 20.0 113.083 173.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.47 -15.16 62.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.714 1.606 . . . . 20.0 112.872 175.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.403 HH11 ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -80.9 139.8 35.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 20.0 110.201 178.361 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -80.5 101.83 9.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.796 -0.816 . . . . 20.0 108.796 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.411 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -156.9 175.49 14.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.07 1.348 . . . . 20.0 109.995 179.55 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -76.91 159.12 30.26 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.697 0.799 . . . . 20.0 109.715 170.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -125.18 144.15 50.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.603 1.161 . . . . 20.0 110.117 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.6 170.71 14.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.403 2.281 . . . . 20.0 110.19 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -104.02 -4.07 23.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.059 1.744 . . . . 20.0 110.812 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.37 -82.46 0.08 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.101 1.76 . . . . 20.0 111.564 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.2 -32.68 61.28 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.135 1.374 . . . . 20.0 112.542 -173.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.94 -25.04 67.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.511 1.124 . . . . 20.0 111.934 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.51 -19.82 63.72 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.355 1.062 . . . . 20.0 113.663 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.8 m -66.53 -56.19 11.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.992 1.317 . . . . 20.0 110.269 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 83.1 m -70.83 -21.79 62.4 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.859 0.864 . . . . 20.0 112.01 173.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.47 -94.06 1.67 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.945 2.212 . . . . 20.0 112.736 172.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -138.48 164.04 30.4 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.782 1.633 . . . . 20.0 111.754 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.57 -16.82 59.93 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.926 1.251 . . . . 20.0 112.783 -170.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 178.5 4.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.988 1.715 . . . . 20.0 112.417 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -150.32 156.21 41.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.579 2.751 . . . . 20.0 108.697 169.017 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 37.4 t -73.97 133.04 42.98 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.597 -0.52 . . . . 20.0 109.597 172.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.6 t -156.06 163.32 39.82 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.666 1.187 . . . . 20.0 110.351 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p -154.17 164.18 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.906 1.283 . . . . 20.0 110.588 176.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -130.77 -173.72 3.16 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.87 1.668 . . . . 20.0 112.497 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 21.3 tp -115.89 151.88 34.48 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.881 2.072 . . . . 20.0 109.529 176.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 73.8 t60 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.387 2.275 . . . . 20.0 113.408 177.499 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 110.114 -0.328 . . . . 20.0 110.114 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -72.16 -43.83 64.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.963 0.905 . . . . 20.0 112.036 -174.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.75 -36.7 83.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.079 0.952 . . . . 20.0 111.983 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.3 t -68.44 -43.3 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.894 1.278 . . . . 20.0 110.513 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.0 m -62.57 -42.82 99.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.175 0.99 . . . . 20.0 111.967 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -66.13 -22.08 66.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.775 1.23 . . . . 20.0 112.663 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.0 3.34 55.87 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.513 1.53 . . . . 20.0 114.597 176.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.91 -179.53 3.23 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.425 1.49 . . . . 20.0 111.684 174.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.6 171.91 13.98 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.955 1.264 . . . . 20.0 113.382 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.08 63.38 0.79 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.715 1.606 . . . . 20.0 110.071 176.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.03 156.21 92.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 124.522 1.129 . . . . 20.0 109.874 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.21 160.67 48.75 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.663 2.242 . . . . 20.0 110.6 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -63.59 -23.15 67.27 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.078 0.951 . . . . 20.0 111.385 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.3 t -59.87 -57.02 14.67 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.016 1.327 . . . . 20.0 111.039 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -85.58 -45.64 11.56 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.589 0.756 . . . . 20.0 111.436 -169.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -65.07 124.27 86.3 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.165 0.986 . . . . 20.0 110.416 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -69.09 161.58 45.26 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.915 2.41 . . . . 20.0 110.776 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -77.75 -0.46 27.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.934 1.294 . . . . 20.0 113.65 -169.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -102.79 -35.23 8.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.25 2.22 . . . . 20.0 112.521 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.95 -12.77 61.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.477 1.111 . . . . 20.0 113.638 175.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -66.99 121.21 15.05 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 124.773 1.229 . . . . 20.0 110.508 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.3 mt -84.26 169.74 14.41 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.803 1.241 . . . . 20.0 112.569 -176.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.6 p -84.36 -16.54 42.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 20.0 112.627 175.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -73.91 172.58 11.33 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.703 2.001 . . . . 20.0 111.809 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.78 -179.15 15.95 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.734 1.635 . . . . 20.0 111.775 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.23 25.18 1.69 Allowed Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.378 0.99 . . . . 20.0 113.845 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.6 m -128.29 -179.77 5.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.671 1.588 . . . . 20.0 111.8 -173.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.6 m -104.5 -11.78 16.84 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.749 0.819 . . . . 20.0 112.215 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.3 p -138.4 -66.81 0.48 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.922 1.289 . . . . 20.0 109.807 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.0 155.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.251 1.82 . . . . 20.0 108.934 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.8 m -82.65 160.1 22.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.035 0.534 . . . . 20.0 110.701 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 t -147.16 119.08 8.13 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.368 0.667 . . . . 20.0 110.051 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -69.75 99.32 1.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.237 1.415 . . . . 20.0 110.262 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 mt -77.23 -13.55 59.92 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.249 1.02 . . . . 20.0 112.663 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.7 t -85.02 -16.11 41.87 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.647 1.579 . . . . 20.0 113.218 -177.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -137.02 17.37 3.01 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.88 1.272 . . . . 20.0 113.212 175.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -40.78 91.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.653 1.181 . . . . 20.0 111.52 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.2 t -135.55 167.58 20.82 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.103 1.361 . . . . 20.0 112.111 -171.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -164.38 -153.39 7.4 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 126.282 1.896 . . . . 20.0 111.486 -174.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.4 t -55.53 -61.42 2.36 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.085 1.354 . . . . 20.0 110.489 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -66.38 -13.33 60.5 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.043 1.737 . . . . 20.0 114.008 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.4 -5.27 81.81 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 124.599 1.095 . . . . 20.0 114.288 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -124.9 -17.09 5.93 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.406 1.882 . . . . 20.0 113.218 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.54 35.39 0.65 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.196 1.379 . . . . 20.0 111.912 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.16 157.47 27.68 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.139 1.352 . . . . 20.0 113.637 -173.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -146.32 155.84 42.92 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.894 1.278 . . . . 20.0 109.822 -175.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 18.8 t -106.55 111.91 24.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.794 1.638 . . . . 20.0 109.135 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -141.48 156.33 66.91 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 127.305 2.242 . . . . 20.0 110.291 -167.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.23 161.25 34.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.226 2.617 . . . . 20.0 113.497 -170.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.489 ' HA ' ' HZ3' ' A' ' 69' ' ' LYS . 86.0 mt -67.07 -18.43 65.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.808 0.843 . . . . 20.0 112.238 174.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -66.85 -22.39 65.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.066 1.747 . . . . 20.0 112.041 172.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.38 122.95 26.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.56 1.544 . . . . 20.0 109.138 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -69.93 104.06 2.41 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.587 1.155 . . . . 20.0 110.574 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 t -159.82 175.75 12.73 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.388 1.475 . . . . 20.0 110.296 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -78.38 141.38 38.41 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.672 1.189 . . . . 20.0 109.372 171.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.84 133.24 49.16 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.121 1.368 . . . . 20.0 109.172 173.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.22 122.16 23.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.393 1.877 . . . . 20.0 111.041 -170.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -64.43 -15.96 61.55 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.748 1.619 . . . . 20.0 114.129 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.47 63.91 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.268 1.427 . . . . 20.0 113.793 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -139.17 -37.68 0.51 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.672 1.189 . . . . 20.0 112.518 -168.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.8 t -64.42 -29.39 70.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.5 1.12 . . . . 20.0 112.447 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.62 72.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.581 0.752 . . . . 20.0 111.711 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.0 m -79.58 -33.14 41.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.045 1.338 . . . . 20.0 111.972 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.7 m -63.87 -34.02 77.01 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.388 1.075 . . . . 20.0 111.47 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.68 170.84 47.25 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 125.728 1.632 . . . . 20.0 112.796 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 126.24 26.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.648 1.179 . . . . 20.0 111.627 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 114.23 -19.68 17.19 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.689 1.614 . . . . 20.0 113.298 -178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -138.44 177.32 7.97 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.222 1.809 . . . . 20.0 111.98 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.489 ' HZ3' ' HA ' ' A' ' 50' ' ' LEU . 5.9 ptpp? -151.31 173.37 14.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.827 2.051 . . . . 20.0 111.492 -176.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.0 t -91.5 147.17 23.21 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.067 0.547 . . . . 20.0 109.779 163.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 49.9 t -144.0 161.17 39.45 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.758 1.223 . . . . 20.0 109.936 172.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.2 t -126.29 156.08 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 126.251 1.821 . . . . 20.0 109.033 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -127.94 -176.13 3.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.68 1.592 . . . . 20.0 112.043 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.6 tp -133.18 169.29 17.09 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.501 1.52 . . . . 20.0 109.467 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 117.016 -1.468 . . . . 20.0 110.935 176.105 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 109.443 -0.577 . . . . 20.0 109.443 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -66.07 -40.73 91.12 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.799 0.839 . . . . 20.0 112.035 -174.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.32 -36.27 81.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.373 1.069 . . . . 20.0 111.97 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 63.0 t -76.71 -41.99 33.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.49 1.516 . . . . 20.0 110.776 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 t -61.59 -44.16 97.53 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.182 1.393 . . . . 20.0 111.976 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -68.25 -12.97 61.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.469 1.508 . . . . 20.0 113.164 176.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.43 1.28 56.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.145 1.355 . . . . 20.0 114.603 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -74.71 175.17 8.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.57 1.185 . . . . 20.0 112.09 -178.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -103.6 175.9 23.77 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.014 1.292 . . . . 20.0 112.399 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -132.77 65.77 1.58 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.599 1.559 . . . . 20.0 109.42 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.94 158.12 87.65 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.135 0.974 . . . . 20.0 110.028 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.34 165.49 30.32 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.183 2.589 . . . . 20.0 111.389 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -60.92 -32.47 71.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.205 0.602 . . . . 20.0 111.374 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -65.66 -45.69 82.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.096 0.958 . . . . 20.0 112.162 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.61 -49.85 10.73 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.024 0.93 . . . . 20.0 111.725 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -67.64 124.94 90.52 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.193 0.997 . . . . 20.0 110.574 -179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.74 160.78 48.17 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.802 2.335 . . . . 20.0 110.25 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -73.09 -18.49 61.3 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.732 0.813 . . . . 20.0 112.735 -170.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.4 -41.17 33.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.98 2.112 . . . . 20.0 112.365 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -9.02 58.2 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.69 1.196 . . . . 20.0 113.488 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -70.5 113.7 7.88 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.518 1.127 . . . . 20.0 110.748 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 37.4 mt -84.88 170.74 12.82 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.187 1.395 . . . . 20.0 111.957 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 98.0 p -82.44 -13.64 56.43 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.337 1.055 . . . . 20.0 113.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -74.76 175.25 8.14 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.804 1.241 . . . . 20.0 112.591 -175.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -137.14 -176.93 14.66 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.35 1.452 . . . . 20.0 112.317 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.46 -4.73 33.04 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.508 1.528 . . . . 20.0 113.332 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.8 m -78.9 176.33 9.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.663 1.185 . . . . 20.0 111.984 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.8 t -111.54 -6.86 14.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.238 1.415 . . . . 20.0 111.579 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.6 p -131.6 -75.42 0.52 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.165 1.786 . . . . 20.0 109.021 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.2 p -165.58 151.89 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 126.852 2.061 . . . . 20.0 108.358 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.6 m -67.8 154.71 40.95 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.388 0.675 . . . . 20.0 111.497 172.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.3 t -151.06 113.69 4.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.589 0.755 . . . . 20.0 110.132 174.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -69.57 102.72 1.9 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.96 0.904 . . . . 20.0 110.165 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 mt -68.7 -22.28 64.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.189 0.996 . . . . 20.0 111.941 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 t -82.9 -7.0 59.7 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.823 1.649 . . . . 20.0 112.884 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -124.64 11.31 8.5 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.243 1.417 . . . . 20.0 112.803 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.76 -40.93 46.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.156 1.382 . . . . 20.0 111.878 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.2 p -122.6 -69.63 0.82 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.685 1.594 . . . . 20.0 111.048 -172.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.3 -148.23 48.82 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.741 1.162 . . . . 20.0 112.592 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.7 m -60.68 -39.22 87.67 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.601 1.16 . . . . 20.0 112.04 171.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt 73.15 -4.11 2.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.679 3.192 . . . . 20.0 114.932 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -99.83 -17.21 26.32 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 118.743 -1.032 . . . . 20.0 114.244 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.6 mmtm -134.98 -36.88 0.81 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.25 1.42 . . . . 20.0 113.434 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.34 31.94 2.48 Favored Glycine 0 CA--C 1.532 1.138 0 CA-C-O 118.847 -0.974 . . . . 20.0 112.538 -170.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.67 179.41 20.17 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.714 1.626 . . . . 20.0 112.21 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -119.88 166.57 13.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.163 1.385 . . . . 20.0 112.323 -171.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 49.2 m -90.84 -43.14 10.23 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.268 1.027 . . . . 20.0 113.758 -173.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.68 171.03 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.217 2.207 . . . . 20.0 114.537 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.85 149.58 66.48 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.261 1.974 . . . . 20.0 110.713 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.58 -24.23 65.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.001 1.32 . . . . 20.0 113.076 177.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -78.11 -8.44 58.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.978 1.711 . . . . 20.0 113.076 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 164.73 26.0 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.587 1.155 . . . . 20.0 110.374 170.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -107.56 104.15 13.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.533 1.533 . . . . 20.0 109.265 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -158.78 167.67 28.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.957 1.703 . . . . 20.0 110.602 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.55 160.45 31.46 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.889 1.275 . . . . 20.0 111.818 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -133.22 114.26 13.61 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 126.247 1.819 . . . . 20.0 109.494 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pp -136.29 103.38 5.28 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.955 1.702 . . . . 20.0 110.235 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -61.26 -12.16 12.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.635 1.974 . . . . 20.0 113.564 -173.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.67 95.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.796 1.638 . . . . 20.0 113.325 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -119.74 -40.39 2.76 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.897 1.279 . . . . 20.0 111.429 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.3 p -70.52 -15.22 62.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.544 1.138 . . . . 20.0 113.911 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.8 18.65 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.534 1.309 . . . . 20.0 114.534 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 59.7 p -112.73 17.86 18.74 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.894 1.678 . . . . 20.0 113.572 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.8 m -67.27 -83.41 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.66 1.184 . . . . 20.0 111.286 174.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.2 -28.84 9.29 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.143 1.354 . . . . 20.0 114.399 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -136.11 35.84 2.8 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.303 1.441 . . . . 20.0 112.805 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -166.69 -45.86 0.02 OUTLIER Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.159 -0.801 . . . . 20.0 113.59 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.55 25.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 129.003 2.921 . . . . 20.0 117.017 -172.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.07 129.42 46.61 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 126.949 2.1 . . . . 20.0 108.749 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.2 t -110.38 127.92 55.32 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.989 0.916 . . . . 20.0 109.279 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.7 t -129.59 120.85 25.97 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.113 1.365 . . . . 20.0 108.855 -174.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.2 t -135.49 110.85 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.974 1.309 . . . . 20.0 108.092 -171.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -80.71 -177.71 6.43 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.936 1.295 . . . . 20.0 111.238 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -136.71 152.62 50.57 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.1 1.36 . . . . 20.0 110.269 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 116.776 -1.583 . . . . 20.0 111.237 175.867 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.345 -0.243 . . . . 20.0 110.345 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -114.96 -43.67 3.09 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 124.429 1.092 . . . . 20.0 111.768 -173.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.2 m -63.91 -39.1 93.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.915 -0.565 . . . . 20.0 111.431 173.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.0 t -66.89 -35.4 74.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.192 0.997 . . . . 20.0 111.132 174.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -65.61 -35.46 80.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.139 0.976 . . . . 20.0 112.106 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.55 -28.06 41.25 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.592 1.157 . . . . 20.0 112.326 176.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.75 -1.32 32.06 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.408 1.48 . . . . 20.0 114.126 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -70.22 176.67 3.73 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.387 1.475 . . . . 20.0 111.588 172.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.96 179.13 20.5 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 125.263 1.411 . . . . 20.0 113.234 -175.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.9 m -132.56 54.43 1.95 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.153 1.781 . . . . 20.0 110.423 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.57 159.92 64.12 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.367 1.467 . . . . 20.0 111.276 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -68.92 158.31 58.42 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.463 2.109 . . . . 20.0 110.931 171.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.13 -24.65 67.77 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.451 1.1 . . . . 20.0 111.589 176.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.7 m -72.62 -19.53 61.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.222 1.409 . . . . 20.0 113.458 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -107.12 -54.34 2.49 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.758 1.223 . . . . 20.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.92 120.55 67.55 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.603 1.161 . . . . 20.0 110.259 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -68.46 165.55 28.68 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.977 2.451 . . . . 20.0 110.735 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -71.16 -14.62 62.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.904 0.882 . . . . 20.0 113.129 -170.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -85.18 -40.7 16.4 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.499 2.32 . . . . 20.0 112.432 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.06 -7.16 52.92 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.634 1.574 . . . . 20.0 113.613 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.57 107.68 5.21 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.458 1.503 . . . . 20.0 110.961 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -72.57 168.32 18.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.004 1.322 . . . . 20.0 112.139 177.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -89.48 -13.94 36.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.43 1.492 . . . . 20.0 112.75 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -66.25 172.31 4.01 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.103 2.161 . . . . 20.0 111.992 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -138.97 -175.83 14.25 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.683 1.135 . . . . 20.0 113.18 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.4 -11.29 56.74 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.115 1.817 . . . . 20.0 113.632 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.3 m -69.7 175.09 4.45 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.58 1.152 . . . . 20.0 112.782 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.5 p -100.06 -14.52 18.58 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.656 1.583 . . . . 20.0 111.84 -176.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 p -141.6 -72.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.917 2.087 . . . . 20.0 109.156 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -159.05 154.02 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.481 1.512 . . . . 20.0 108.703 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 67.9 m -72.45 161.15 31.19 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.883 0.473 . . . . 20.0 111.711 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.3 120.86 6.92 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.163 0.985 . . . . 20.0 109.988 171.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -70.24 92.84 0.8 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 20.0 111.827 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.8 -37.07 86.38 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.496 1.119 . . . . 20.0 112.182 -174.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.1 t -63.04 -31.61 72.79 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.494 1.118 . . . . 20.0 111.95 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp -101.63 2.62 39.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.429 1.091 . . . . 20.0 113.396 -176.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -52.18 20.39 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.189 1.396 . . . . 20.0 110.934 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.5 p 36.78 82.49 0.02 OUTLIER 'General case' 0 C--N 1.342 0.256 0 C-N-CA 129.133 2.973 . . . . 20.0 113.285 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -73.81 172.1 51.42 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.086 -1.415 . . . . 20.0 112.436 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 74.1 m -108.72 -41.86 4.67 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.435 1.494 . . . . 20.0 111.274 -174.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -59.0 -36.17 74.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.828 2.051 . . . . 20.0 113.616 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -65.65 -73.09 0.64 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.614 1.578 . . . . 20.0 113.027 -171.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -68.86 -24.84 64.4 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.654 1.182 . . . . 20.0 112.008 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 86.0 -26.25 6.24 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.475 1.988 . . . . 20.0 112.907 -172.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.17 -171.3 48.83 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.175 1.369 . . . . 20.0 114.066 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.3 176.58 7.83 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.447 1.499 . . . . 20.0 112.002 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.0 t -108.46 101.48 10.65 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.007 1.323 . . . . 20.0 110.15 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -130.32 154.64 81.52 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 128.352 2.661 . . . . 20.0 110.945 -170.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.83 162.1 41.08 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.159 2.572 . . . . 20.0 113.221 -170.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.417 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 83.8 mt -66.39 -20.9 66.19 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.138 0.575 . . . . 20.0 112.142 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -69.37 -20.06 63.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.814 1.646 . . . . 20.0 112.391 174.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -68.46 144.59 54.61 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.371 1.068 . . . . 20.0 109.286 171.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -90.1 100.82 13.57 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.306 0.642 . . . . 20.0 109.797 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.39 176.73 9.54 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.737 1.615 . . . . 20.0 111.014 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -117.44 109.94 17.38 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.038 1.335 . . . . 20.0 111.138 -171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.521 ' HA ' ' H ' ' A' ' 70' ' ' CYS . 1.8 pm0 -64.84 173.31 2.34 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.271 2.229 . . . . 20.0 114.507 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.1 mt -147.41 129.87 15.83 Favored 'General case' 0 C--N 1.347 0.462 0 C-N-CA 126.578 1.951 . . . . 20.0 109.847 167.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -64.29 -12.49 42.09 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.505 0.928 . . . . 20.0 113.505 166.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.86 -70.86 0.43 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.408 1.483 . . . . 20.0 110.969 167.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -85.31 -49.63 8.01 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.07 0.948 . . . . 20.0 112.865 -166.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 p -70.17 -7.01 38.41 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.615 1.166 . . . . 20.0 113.398 -174.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.79 -14.3 62.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.31 1.444 . . . . 20.0 113.663 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.9 t -64.8 -54.83 24.95 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.843 1.257 . . . . 20.0 112.584 -175.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.7 m -74.37 -15.44 60.93 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 118.709 -0.663 . . . . 20.0 112.322 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.39 -154.73 35.08 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-N 119.382 0.992 . . . . 20.0 112.925 175.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -60.19 110.34 1.2 Allowed 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.224 1.41 . . . . 20.0 110.602 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 124.59 -0.1 8.59 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.517 1.532 . . . . 20.0 113.325 -175.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -119.96 149.1 42.67 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.567 1.547 . . . . 20.0 111.596 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 17.2 ptpt -141.34 151.23 43.39 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.779 2.031 . . . . 20.0 109.461 165.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.521 ' H ' ' HA ' ' A' ' 56' ' ' GLU . 8.5 t -63.67 132.28 50.61 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.369 -0.604 . . . . 20.0 109.369 172.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.3 t -157.17 115.09 3.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.778 0.831 . . . . 20.0 110.37 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.75 160.02 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.617 1.167 . . . . 20.0 111.029 170.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -126.4 -178.96 4.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.206 1.803 . . . . 20.0 112.342 -174.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.6 133.83 39.19 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.709 1.604 . . . . 20.0 107.83 173.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.2 m170 . . . . . 0 C--O 1.238 0.487 0 C-N-CA 126.846 2.059 . . . . 20.0 112.182 -172.877 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 110.1 -0.333 . . . . 20.0 110.1 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -64.68 -45.84 84.95 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.993 0.917 . . . . 20.0 110.827 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 39.1 m -64.28 -36.63 84.72 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.879 1.272 . . . . 20.0 112.876 -172.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.8 t -65.6 -46.03 90.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.186 1.394 . . . . 20.0 110.815 174.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 -40.87 98.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.736 1.614 . . . . 20.0 112.828 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -69.96 -27.78 65.01 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.823 1.649 . . . . 20.0 112.924 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.15 41.72 2.96 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.586 -1.119 . . . . 20.0 113.61 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -120.86 175.27 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.519 1.528 . . . . 20.0 111.72 176.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 171.51 26.68 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 124.913 1.245 . . . . 20.0 113.678 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.8 m -126.77 39.95 3.82 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.052 1.741 . . . . 20.0 111.318 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.74 153.84 20.44 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 20.0 110.934 175.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.45 155.97 65.47 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.618 2.212 . . . . 20.0 111.358 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.64 -20.25 66.17 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.776 1.231 . . . . 20.0 111.696 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -76.16 -8.69 57.59 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.825 1.65 . . . . 20.0 113.224 173.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -118.21 -66.65 1.06 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.618 1.567 . . . . 20.0 110.542 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.24 147.54 98.84 Favored Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 118.299 0.5 . . . . 20.0 112.04 -174.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.11 167.24 27.86 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.525 2.817 . . . . 20.0 111.147 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.52 9.99 8.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.973 1.709 . . . . 20.0 113.236 -170.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -121.45 -34.78 3.38 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 126.52 1.928 . . . . 20.0 113.193 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.04 -7.81 44.16 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.291 1.436 . . . . 20.0 112.973 173.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.03 108.29 4.52 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.611 1.564 . . . . 20.0 111.614 -175.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.8 mt -72.35 169.82 15.49 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.085 1.754 . . . . 20.0 112.797 -176.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.3 p -86.55 -17.71 33.35 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.152 1.381 . . . . 20.0 112.927 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -71.78 171.92 10.76 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.518 1.927 . . . . 20.0 111.913 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.99 149.71 19.64 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 125.313 1.435 . . . . 20.0 110.313 169.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 156.26 23.42 0.03 OUTLIER Glycine 0 CA--C 1.531 1.056 0 CA-C-O 118.633 -1.093 . . . . 20.0 114.004 -176.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.8 m -135.91 176.88 8.28 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.426 1.49 . . . . 20.0 112.115 -172.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -89.4 -19.59 25.0 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.461 1.104 . . . . 20.0 112.302 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -142.37 -66.39 0.39 Allowed 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.19 1.396 . . . . 20.0 110.747 -168.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.87 141.19 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.926 1.29 . . . . 20.0 109.466 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.4 m -78.64 104.44 9.25 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.625 1.17 . . . . 20.0 109.604 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.9 t -100.56 117.2 34.21 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.226 1.01 . . . . 20.0 110.819 -177.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -66.71 99.68 0.63 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.079 1.752 . . . . 20.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.0 mt -74.49 -18.27 60.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.367 1.067 . . . . 20.0 112.943 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.4 t -72.37 -21.68 61.25 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.268 1.027 . . . . 20.0 112.822 -176.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.07 -2.72 16.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.031 1.732 . . . . 20.0 113.58 175.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.8 tp -89.87 -43.67 10.45 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.799 1.64 . . . . 20.0 111.196 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.1 p -103.3 171.16 7.53 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.612 1.565 . . . . 20.0 111.193 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 86.34 162.38 36.85 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.294 1.426 . . . . 20.0 112.424 -178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 39.0 t -64.35 -49.54 71.28 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.716 1.206 . . . . 20.0 110.722 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -70.48 -13.2 62.02 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.694 1.598 . . . . 20.0 114.008 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -65.51 -77.01 0.28 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 125.954 1.74 . . . . 20.0 111.977 -173.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.0 -25.09 65.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.257 0.623 . . . . 20.0 111.893 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.2 -7.91 32.89 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.662 2.077 . . . . 20.0 113.066 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.74 156.66 6.22 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.618 1.58 . . . . 20.0 112.531 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -92.41 140.19 29.83 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.038 0.935 . . . . 20.0 110.281 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.94 8.67 22.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.851 1.66 . . . . 20.0 113.092 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.72 150.25 1.3 Allowed Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.389 2.676 . . . . 20.0 113.44 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -64.92 159.84 44.17 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 123.196 2.597 . . . . 20.0 112.849 -170.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 71.7 mt -62.49 -20.51 64.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.342 0.657 . . . . 20.0 112.501 170.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -78.45 -17.62 56.08 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.562 1.545 . . . . 20.0 113.24 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 158.01 33.02 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.642 1.177 . . . . 20.0 110.807 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -70.92 -9.28 57.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.807 1.643 . . . . 20.0 114.641 -174.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.9 m -60.07 154.93 18.11 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 125.336 1.454 . . . . 20.0 111.61 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -154.38 118.32 4.7 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.126 1.37 . . . . 20.0 110.687 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 6.8 tp10 -158.75 -168.67 2.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.248 1.419 . . . . 20.0 109.887 174.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.512 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.9 pp -59.7 158.35 10.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.962 1.705 . . . . 20.0 113.146 171.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -114.84 -10.28 12.38 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.694 1.598 . . . . 20.0 113.291 174.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.15 -56.26 24.35 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 124.058 0.943 . . . . 20.0 112.295 -176.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -85.6 -27.56 25.4 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.893 0.877 . . . . 20.0 112.362 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.48 -32.77 74.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.1 0.96 . . . . 20.0 112.668 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.87 -1.76 0.71 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.507 2.323 . . . . 20.0 115.921 -168.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.6 m -58.66 -22.7 57.6 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.87 1.268 . . . . 20.0 113.594 172.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.43 -8.44 58.49 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.758 1.163 . . . . 20.0 113.793 171.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 89.02 -73.77 2.1 Favored Glycine 0 C--N 1.343 0.935 0 C-N-CA 125.433 1.492 . . . . 20.0 112.306 172.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -133.43 151.64 51.83 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.182 1.793 . . . . 20.0 109.098 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.0 42.45 98.23 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 118.344 -1.253 . . . . 20.0 113.772 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.19 157.92 40.45 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.896 1.278 . . . . 20.0 112.239 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 12.9 ptpt -166.12 132.9 2.63 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.55 1.54 . . . . 20.0 110.512 171.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 156.76 36.33 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.788 0.435 . . . . 20.0 111.207 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.5 t -164.99 13.62 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.736 0.814 . . . . 20.0 112.698 -170.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.1 t -60.78 139.22 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.037 1.335 . . . . 20.0 111.103 -169.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -110.35 -176.14 2.91 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.96 1.304 . . . . 20.0 113.347 -169.133 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.0 tp -114.82 -71.75 0.73 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.453 1.501 . . . . 20.0 109.779 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 52.9 t60 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 125.727 1.611 . . . . 20.0 110.022 179.682 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 110.348 -0.241 . . . . 20.0 110.348 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -113.97 -50.72 2.81 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.023 0.929 . . . . 20.0 110.421 175.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.7 t -62.92 -42.75 99.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.588 0.755 . . . . 20.0 112.327 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.33 -39.82 72.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.01 0.924 . . . . 20.0 110.796 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 t -63.04 -34.05 76.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.822 1.249 . . . . 20.0 112.899 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -74.39 -19.14 60.53 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.795 1.638 . . . . 20.0 112.706 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.37 14.59 35.04 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.945 1.26 . . . . 20.0 114.538 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -75.4 175.04 8.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.765 1.283 . . . . 20.0 112.231 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.5 1.95 13.97 Favored Glycine 0 C--N 1.343 0.962 0 N-CA-C 117.481 1.752 . . . . 20.0 117.481 -160.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m 34.34 61.92 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.266 2.627 . . . . 20.0 113.69 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.5 157.05 87.13 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.296 0.638 . . . . 20.0 109.939 173.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.04 165.39 32.74 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.985 2.457 . . . . 20.0 111.156 174.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -59.87 -38.95 83.66 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.498 0.719 . . . . 20.0 110.664 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 88.9 p -67.38 -10.05 47.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.009 1.724 . . . . 20.0 115.056 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -122.24 -45.05 2.24 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 124.753 1.221 . . . . 20.0 111.001 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.2 t -65.14 119.44 58.89 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.926 1.29 . . . . 20.0 110.331 175.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.15 155.09 72.19 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.357 2.038 . . . . 20.0 110.201 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -69.37 -19.68 63.83 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.215 1.006 . . . . 20.0 112.641 -167.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -74.97 -39.12 61.46 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.76 2.424 . . . . 20.0 112.675 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.47 -9.66 59.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.508 1.123 . . . . 20.0 113.459 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -69.72 117.53 11.43 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 124.007 0.923 . . . . 20.0 110.528 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 mt -88.06 176.38 7.33 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.519 1.528 . . . . 20.0 111.46 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.3 p -105.45 -6.75 19.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.335 1.454 . . . . 20.0 114.004 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.97 172.54 7.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.712 1.205 . . . . 20.0 111.855 175.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.27 177.39 17.2 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.877 1.227 . . . . 20.0 112.771 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.14 -4.1 31.61 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.767 1.651 . . . . 20.0 114.397 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.3 m -77.4 179.85 6.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.233 1.413 . . . . 20.0 112.468 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.7 m -103.16 -11.95 17.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.4 1.08 . . . . 20.0 112.233 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 p -138.32 -71.98 0.41 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.055 1.742 . . . . 20.0 109.654 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -158.36 153.39 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 126.196 1.798 . . . . 20.0 108.724 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 60.9 m -74.26 155.04 38.68 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.519 0.728 . . . . 20.0 111.033 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.9 t -149.32 114.2 5.39 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.394 0.678 . . . . 20.0 110.526 176.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.27 108.58 4.25 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.496 1.118 . . . . 20.0 110.915 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.63 -27.4 58.41 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.763 0.825 . . . . 20.0 113.088 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -73.95 -11.79 60.45 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.084 1.142 . . . . 20.0 114.084 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -124.95 20.44 8.33 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.075 2.15 . . . . 20.0 111.355 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tt -128.36 -45.11 1.37 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.679 1.992 . . . . 20.0 109.387 -177.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.4 p -124.62 171.43 10.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.439 1.896 . . . . 20.0 110.935 177.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.98 -103.28 0.26 Allowed Glycine 0 C--N 1.341 0.837 0 C-N-CA 125.396 1.474 . . . . 20.0 110.246 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 t -87.18 -64.88 1.08 Allowed 'General case' 0 C--N 1.343 0.305 0 CA-C-N 117.799 0.8 . . . . 20.0 110.565 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -139.26 -32.76 0.65 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.657 0.984 . . . . 20.0 113.657 -171.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.83 -67.68 0.08 OUTLIER Glycine 0 C--N 1.343 0.932 0 CA-C-N 119.363 0.983 . . . . 20.0 112.549 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp -68.74 -26.31 65.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.281 1.032 . . . . 20.0 112.823 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.61 -43.04 1.15 Allowed Glycine 0 C--N 1.339 0.702 0 C-N-CA 125.262 1.41 . . . . 20.0 111.146 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.37 167.58 43.78 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.497 1.523 . . . . 20.0 112.459 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.18 157.85 44.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.503 1.921 . . . . 20.0 110.819 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -82.06 109.36 16.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.152 0.981 . . . . 20.0 109.394 173.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -127.1 155.01 76.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.236 2.214 . . . . 20.0 109.971 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.45 164.78 27.25 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.981 3.121 . . . . 20.0 113.428 -168.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 48.6 mt -59.97 -28.85 68.01 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.518 0.727 . . . . 20.0 111.588 168.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.21 -18.51 65.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.696 1.598 . . . . 20.0 112.725 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -65.98 -30.47 71.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.621 1.168 . . . . 20.0 112.316 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.88 1.11 0.78 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.646 2.378 . . . . 20.0 115.612 173.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.6 p -65.59 167.76 8.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.805 1.242 . . . . 20.0 111.68 172.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -63.68 134.15 54.87 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.253 1.021 . . . . 20.0 110.018 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.96 172.55 12.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.611 1.165 . . . . 20.0 112.116 175.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 162.54 29.47 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.978 2.111 . . . . 20.0 110.979 172.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -88.02 -2.28 58.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.633 1.573 . . . . 20.0 113.336 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.29 -70.2 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.483 1.513 . . . . 20.0 110.742 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -83.98 -27.19 28.63 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.499 0.926 . . . . 20.0 113.499 -176.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.3 p -66.19 -21.94 66.33 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.14 -11.0 35.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.993 1.317 . . . . 20.0 112.685 173.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.6 t -107.34 -30.57 8.62 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.887 1.675 . . . . 20.0 112.198 171.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 75.0 m -61.61 -27.23 68.51 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.368 0.986 . . . . 20.0 112.516 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.5 166.77 42.81 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.249 1.404 . . . . 20.0 112.712 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -62.94 133.84 55.27 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.789 1.236 . . . . 20.0 111.067 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.27 -2.41 65.5 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.162 1.363 . . . . 20.0 113.353 -172.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -149.96 137.8 20.15 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.921 1.361 . . . . 20.0 111.814 -170.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.58 172.37 12.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.642 1.977 . . . . 20.0 112.146 -174.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.89 137.58 51.76 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 122.009 -0.432 . . . . 20.0 109.976 167.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.6 t -138.27 168.33 19.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.783 1.633 . . . . 20.0 108.576 163.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p -151.94 162.81 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 123.169 0.587 . . . . 20.0 109.966 170.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -123.19 -178.79 4.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.429 1.492 . . . . 20.0 112.14 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 91.6 mt -103.29 154.38 19.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.598 1.159 . . . . 20.0 109.189 169.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 124.867 1.267 . . . . 20.0 111.3 -176.104 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 51.7 m-20 . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 121.345 0.593 . . . . 20.0 109.639 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -67.91 -40.59 83.38 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.713 1.205 . . . . 20.0 111.366 -173.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.4 t -70.65 -37.42 73.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.542 1.137 . . . . 20.0 112.239 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.31 -37.63 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.305 . . . . 20.0 110.709 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.2 t -58.28 -37.55 75.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.875 1.27 . . . . 20.0 112.075 178.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -77.77 -46.28 22.13 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.518 1.127 . . . . 20.0 111.575 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.59 63.63 2.56 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.419 1.009 . . . . 20.0 112.378 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -95.28 -102.26 0.16 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.57 1.548 . . . . 20.0 108.741 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.58 165.58 35.08 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.153 1.359 . . . . 20.0 111.416 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.9 m -125.45 55.96 1.39 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.276 1.43 . . . . 20.0 110.132 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.42 154.74 90.13 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.074 0.95 . . . . 20.0 109.803 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -69.79 160.08 51.02 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.026 2.484 . . . . 20.0 110.408 170.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.9 -37.31 84.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.768 0.827 . . . . 20.0 112.074 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.0 m -68.72 -21.69 64.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.781 1.03 . . . . 20.0 113.781 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -92.06 -51.13 5.34 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.503 1.121 . . . . 20.0 110.571 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.3 t -62.93 118.51 43.05 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 125.517 1.527 . . . . 20.0 110.941 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.01 155.57 69.13 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.382 2.055 . . . . 20.0 110.206 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -74.08 -16.26 61.04 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.627 1.171 . . . . 20.0 112.72 -165.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.55 -39.82 64.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.649 2.38 . . . . 20.0 112.239 170.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.16 -11.18 59.77 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.612 1.165 . . . . 20.0 113.455 -176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -67.54 112.68 4.83 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.806 0.842 . . . . 20.0 110.694 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.6 mt -78.12 175.99 9.62 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.368 1.867 . . . . 20.0 111.153 174.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.7 p -110.81 -0.25 17.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.719 1.608 . . . . 20.0 112.804 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -72.07 171.57 11.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.73 1.212 . . . . 20.0 111.906 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -129.69 141.84 13.02 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.032 1.301 . . . . 20.0 111.275 174.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 150.09 -14.69 1.0 Allowed Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.763 1.173 . . . . 20.0 114.101 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -77.72 -179.55 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.899 1.35 . . . . 20.0 112.371 172.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.1 t -107.02 -9.53 16.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.496 1.518 . . . . 20.0 111.766 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 p -137.54 -69.61 0.45 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 125.425 1.49 . . . . 20.0 110.158 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.2 p -159.26 144.32 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 20.0 109.86 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 92.4 m -72.99 120.33 18.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.537 1.535 . . . . 20.0 110.173 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.0 t -126.33 108.34 11.15 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.544 1.138 . . . . 20.0 110.607 -171.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -65.04 106.09 1.19 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.54 1.936 . . . . 20.0 111.29 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.2 mt -80.67 -18.2 48.77 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.934 0.894 . . . . 20.0 112.913 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -77.51 -10.57 59.56 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.761 1.225 . . . . 20.0 113.398 -175.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -114.98 0.18 13.6 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.05 1.74 . . . . 20.0 112.998 172.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.6 tp -86.74 -48.18 8.48 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.063 1.745 . . . . 20.0 111.065 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.4 p -76.9 170.91 15.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.634 1.574 . . . . 20.0 112.421 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.92 165.26 14.82 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 126.192 1.853 . . . . 20.0 112.272 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.78 -46.7 68.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.646 0.779 . . . . 20.0 110.516 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -84.02 -15.37 47.86 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.189 1.396 . . . . 20.0 113.117 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.72 -52.31 51.56 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 124.816 1.198 . . . . 20.0 111.561 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -88.99 -21.61 23.43 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.142 1.377 . . . . 20.0 112.5 170.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.6 -24.54 16.8 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.617 1.58 . . . . 20.0 114.094 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.53 -162.66 37.12 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.708 1.147 . . . . 20.0 114.275 173.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -120.99 141.35 50.81 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.121 1.768 . . . . 20.0 109.208 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.9 t -89.05 17.08 6.14 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.928 1.291 . . . . 20.0 113.153 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -43.9 153.02 0.43 Allowed Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 128.92 2.888 . . . . 20.0 114.378 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.85 161.87 44.28 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.618 2.878 . . . . 20.0 112.474 -177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.8 mt -63.62 -18.96 64.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.846 1.258 . . . . 20.0 112.272 172.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -69.45 -25.65 64.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.356 1.463 . . . . 20.0 112.577 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -69.95 160.59 31.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.183 0.993 . . . . 20.0 111.238 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -74.33 97.77 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.381 1.072 . . . . 20.0 110.896 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 98.7 m -153.77 154.84 34.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.782 2.433 . . . . 20.0 109.07 174.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -154.99 92.21 1.43 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.076 1.35 . . . . 20.0 110.394 175.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.48 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.5 tp10 -153.94 -174.7 5.06 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.191 0.996 . . . . 20.0 110.897 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.48 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.5 pp -57.07 158.46 5.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.965 1.706 . . . . 20.0 113.826 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -118.56 -9.11 10.34 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.751 2.021 . . . . 20.0 112.654 175.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -20.0 65.0 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.053 1.341 . . . . 20.0 114.069 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -124.67 -17.92 5.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.344 1.458 . . . . 20.0 111.843 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.5 t -79.29 -20.94 46.76 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.978 1.311 . . . . 20.0 113.498 177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -0.46 5.72 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.239 1.415 . . . . 20.0 114.449 -174.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.6 t -56.64 -45.01 81.85 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.75 1.22 . . . . 20.0 111.602 166.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -69.99 -6.41 33.12 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.485 1.114 . . . . 20.0 113.461 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.21 -166.62 14.57 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.714 1.626 . . . . 20.0 112.389 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.03 46.42 0.39 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.416 1.886 . . . . 20.0 110.537 168.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -150.33 3.99 0.57 Allowed Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.46 1.981 . . . . 20.0 113.329 -173.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -142.61 152.98 43.07 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.675 1.738 . . . . 20.0 110.817 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -132.49 147.98 52.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.582 2.353 . . . . 20.0 108.114 165.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.2 t -60.8 142.74 55.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.848 0.356 . . . . 20.0 111.074 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.9 t -158.17 4.66 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.038 0.755 . . . . 20.0 113.038 -171.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -79.02 160.54 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.347 1.459 . . . . 20.0 111.69 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -132.92 179.09 6.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.481 1.512 . . . . 20.0 113.539 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.73 156.84 34.27 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.585 1.554 . . . . 20.0 111.023 168.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.76 1.624 . . . . 20.0 109.189 172.213 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 61.1 m-20 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 110.455 -0.202 . . . . 20.0 110.455 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -73.89 -75.3 0.16 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.186 0.595 . . . . 20.0 110.698 176.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 p -68.46 -28.25 66.88 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 114.557 1.317 . . . . 20.0 114.557 -167.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.0 t -57.27 -49.34 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.544 1.138 . . . . 20.0 109.617 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.4 t -71.65 -27.26 62.95 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.733 1.213 . . . . 20.0 112.786 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -67.52 -24.97 65.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.208 1.003 . . . . 20.0 112.419 175.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.23 -1.11 14.52 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.181 1.372 . . . . 20.0 114.176 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -77.95 172.14 13.93 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.753 1.277 . . . . 20.0 112.222 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.9 -7.04 29.73 Favored Glycine 0 C--N 1.341 0.839 0 N-CA-C 118.019 1.968 . . . . 20.0 118.019 -153.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.0 m 37.54 53.93 1.41 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.801 2.44 . . . . 20.0 113.76 -171.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.55 154.25 80.27 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 123.166 0.587 . . . . 20.0 109.646 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.7 161.97 41.41 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.86 2.373 . . . . 20.0 111.256 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -65.64 -18.33 65.24 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.403 0.681 . . . . 20.0 111.604 175.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.7 m -68.29 -43.57 77.42 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.681 1.192 . . . . 20.0 112.231 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -89.4 -48.34 7.4 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.821 0.848 . . . . 20.0 112.285 -174.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.19 118.92 51.28 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.004 1.321 . . . . 20.0 110.683 -176.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -71.06 157.99 56.32 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.916 2.41 . . . . 20.0 110.042 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -73.26 -16.58 61.39 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.0 0.92 . . . . 20.0 112.954 -164.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -72.44 -40.47 67.05 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.174 2.59 . . . . 20.0 112.221 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 -6.78 59.51 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.615 1.566 . . . . 20.0 113.616 -176.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -71.53 101.99 2.6 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 123.868 0.867 . . . . 20.0 111.036 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.73 170.86 7.19 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.085 1.754 . . . . 20.0 111.178 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.6 t -110.47 -3.21 16.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.486 1.514 . . . . 20.0 112.984 -174.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -63.74 175.38 1.13 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.243 1.817 . . . . 20.0 111.85 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.79 178.53 16.35 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.235 1.398 . . . . 20.0 112.754 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.06 -3.85 33.63 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.97 1.271 . . . . 20.0 115.085 171.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.7 m -77.48 176.38 8.94 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.196 1.498 . . . . 20.0 113.143 177.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -85.7 -17.67 35.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.728 -1.124 . . . . 20.0 110.84 166.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -143.08 -70.83 0.32 Allowed 'General case' 0 C--N 1.344 0.357 0 C-N-CA 125.428 1.491 . . . . 20.0 111.783 -168.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -164.88 137.38 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.506 1.522 . . . . 20.0 109.412 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -70.48 128.09 34.95 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.439 1.096 . . . . 20.0 109.491 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.8 t -130.89 114.71 15.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.574 1.149 . . . . 20.0 110.609 -172.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -67.11 121.4 15.53 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.327 0.584 . . . . 20.0 112.138 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.47 -26.22 14.91 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.694 1.198 . . . . 20.0 112.164 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.2 m -68.55 -10.94 58.93 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.397 1.479 . . . . 20.0 114.187 -173.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.3 ptmm? -135.55 5.32 3.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.419 1.887 . . . . 20.0 113.17 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.32 -44.28 68.57 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.915 1.286 . . . . 20.0 111.892 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.1 p -110.16 -75.69 0.62 Allowed 'General case' 0 C--N 1.344 0.366 0 C-N-CA 124.976 1.31 . . . . 20.0 111.316 -174.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 152.54 -98.7 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.453 1.025 . . . . 20.0 111.438 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.43 -37.66 73.14 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.192 1.397 . . . . 20.0 112.634 -176.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -70.95 -9.31 57.66 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.952 1.701 . . . . 20.0 114.108 -174.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.15 -61.94 5.9 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 124.558 1.075 . . . . 20.0 111.986 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -70.85 -21.9 62.38 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.858 1.663 . . . . 20.0 113.401 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 105.67 54.37 0.73 Allowed Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.559 1.076 . . . . 20.0 112.016 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.62 177.5 18.99 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 124.974 1.273 . . . . 20.0 113.357 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.32 157.53 45.42 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.563 1.545 . . . . 20.0 112.581 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -101.28 44.96 0.99 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.13 2.172 . . . . 20.0 111.185 -168.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -63.72 163.88 19.2 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.624 1.97 . . . . 20.0 113.49 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.31 163.46 34.36 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.824 3.016 . . . . 20.0 112.83 -177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.5 mt -68.04 -20.46 64.98 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.656 1.182 . . . . 20.0 112.003 171.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.99 -39.99 96.41 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.928 1.691 . . . . 20.0 111.031 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -74.37 132.45 42.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.305 1.042 . . . . 20.0 109.058 173.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.73 122.83 22.99 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.145 0.578 . . . . 20.0 110.062 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -168.7 166.44 11.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.401 1.48 . . . . 20.0 111.233 176.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -77.58 166.16 23.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.939 1.296 . . . . 20.0 110.665 174.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -132.6 140.65 48.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.449 1.499 . . . . 20.0 110.393 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.1 118.59 16.88 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.785 2.034 . . . . 20.0 110.885 -171.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -63.32 -17.45 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.986 1.314 . . . . 20.0 114.527 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.76 -20.38 61.19 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.95 1.3 . . . . 20.0 113.834 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -139.32 -37.0 0.51 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.97 . . . . 20.0 112.286 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.9 t -69.55 -21.55 63.62 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.749 1.219 . . . . 20.0 112.724 178.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.09 -8.78 18.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.888 0.875 . . . . 20.0 112.822 172.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.7 t -100.49 -26.76 13.74 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.288 1.435 . . . . 20.0 112.436 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 94.3 m -66.38 -44.64 82.57 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.178 0.899 . . . . 20.0 110.632 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 68.75 -179.27 22.87 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.603 1.097 . . . . 20.0 113.487 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -50.12 135.17 21.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.735 1.614 . . . . 20.0 112.398 -176.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.19 -28.58 15.08 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.194 1.854 . . . . 20.0 113.242 -175.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -142.51 -178.79 5.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.5 1.52 . . . . 20.0 111.734 -176.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -165.72 152.59 10.0 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.962 1.305 . . . . 20.0 111.361 -175.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.93 148.16 36.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.252 0.621 . . . . 20.0 110.128 166.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 20.2 t -149.21 140.82 23.44 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.918 1.687 . . . . 20.0 108.292 170.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 t -133.94 160.53 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.927 1.291 . . . . 20.0 109.257 -169.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -126.06 -178.21 4.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.077 1.351 . . . . 20.0 112.792 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.41 -11.1 8.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.938 1.295 . . . . 20.0 112.729 -175.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.175 1.39 . . . . 20.0 110.0 -175.805 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.4 p30 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.432 0.158 . . . . 20.0 111.421 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -127.17 -42.79 1.68 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.334 1.054 . . . . 20.0 111.876 -175.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -58.66 -38.51 78.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.269 0.627 . . . . 20.0 110.785 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.14 -43.26 95.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.489 1.516 . . . . 20.0 110.986 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.3 m -63.26 -36.25 83.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.408 1.083 . . . . 20.0 112.41 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.1 -12.06 60.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.875 1.27 . . . . 20.0 112.751 176.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.59 1.19 53.07 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.61 1.576 . . . . 20.0 115.008 173.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -79.54 179.92 7.2 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.61 1.564 . . . . 20.0 111.995 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.1 174.91 15.44 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.603 1.573 . . . . 20.0 113.064 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.3 m -118.24 41.87 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.134 1.374 . . . . 20.0 112.054 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 143.9 97.49 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 122.976 0.51 . . . . 20.0 109.885 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.58 166.62 29.33 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.439 2.759 . . . . 20.0 112.797 -173.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -64.38 -25.74 68.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.564 1.545 . . . . 20.0 112.362 178.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.2 m -77.72 -12.85 60.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.435 1.494 . . . . 20.0 113.815 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.87 -66.97 1.03 Allowed 'General case' 0 C--N 1.344 0.351 0 C-N-CA 124.577 1.151 . . . . 20.0 110.513 -170.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.4 158.54 28.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.462 0.705 . . . . 20.0 112.075 176.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -83.13 170.13 12.38 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.847 3.031 . . . . 20.0 111.892 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -83.77 -5.65 59.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.335 1.454 . . . . 20.0 113.337 -173.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -90.75 -32.43 16.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.82 2.048 . . . . 20.0 112.196 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.02 2.63 12.24 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.909 1.684 . . . . 20.0 113.672 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -85.7 102.73 13.87 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.221 1.008 . . . . 20.0 112.704 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.1 mt -74.77 176.42 7.05 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.346 1.858 . . . . 20.0 111.721 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.9 t -137.2 19.15 2.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.169 1.388 . . . . 20.0 113.226 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.06 -100.71 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.563 1.945 . . . . 20.0 111.176 171.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.16 177.8 28.8 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 128.178 2.799 . . . . 20.0 111.407 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.33 38.0 3.64 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 119.092 -0.838 . . . . 20.0 113.931 176.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 68.9 m -132.8 179.39 6.19 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.556 1.543 . . . . 20.0 111.171 176.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.1 m -108.65 -6.28 16.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.397 1.079 . . . . 20.0 112.284 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.1 p -136.77 -67.79 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.644 1.578 . . . . 20.0 109.852 174.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -165.81 163.2 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 127.75 2.42 . . . . 20.0 107.946 -173.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.8 m -97.49 157.73 15.85 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.556 0.743 . . . . 20.0 111.727 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.3 t -146.34 118.22 8.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.418 1.487 . . . . 20.0 109.94 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.96 96.89 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.424 1.09 . . . . 20.0 113.215 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.7 mt -69.26 -9.01 51.18 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.844 1.258 . . . . 20.0 113.585 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.1 t -101.1 -7.58 23.06 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.966 1.306 . . . . 20.0 112.795 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -124.66 0.79 8.17 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.882 1.673 . . . . 20.0 112.898 -177.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.64 -36.44 57.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.978 1.711 . . . . 20.0 112.424 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 65.8 p -128.65 168.83 15.22 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.793 1.637 . . . . 20.0 111.481 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 147.15 -164.04 28.65 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 125.45 1.5 . . . . 20.0 111.1 -176.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.3 m -75.07 -65.18 0.91 Allowed 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.465 -0.432 . . . . 20.0 110.312 165.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 tmtp? 52.93 17.74 0.94 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.497 1.919 . . . . 20.0 114.262 -174.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.36 -153.32 10.22 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 126.214 1.864 . . . . 20.0 111.693 173.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -65.6 -32.19 73.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.256 1.022 . . . . 20.0 112.753 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.66 -14.48 2.92 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.395 1.474 . . . . 20.0 114.407 174.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.67 172.11 48.62 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.353 1.454 . . . . 20.0 112.745 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -136.8 171.34 14.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.591 1.556 . . . . 20.0 111.438 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 57.3 m -74.68 25.09 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.138 2.175 . . . . 20.0 114.565 -172.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -55.46 154.02 13.08 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 125.088 1.355 . . . . 20.0 111.116 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.44 163.11 38.52 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.553 2.835 . . . . 20.0 111.782 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.76 -13.89 62.51 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.08 1.352 . . . . 20.0 112.512 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -68.87 -31.78 70.97 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.209 1.404 . . . . 20.0 111.825 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -72.39 135.05 45.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.596 0.758 . . . . 20.0 109.82 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -80.84 104.28 11.25 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.362 1.465 . . . . 20.0 110.952 -176.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.477 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 1.3 m -162.04 165.55 27.13 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.466 1.906 . . . . 20.0 110.274 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -68.48 162.11 26.29 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.37 1.068 . . . . 20.0 111.671 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -133.96 125.11 27.51 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.406 1.482 . . . . 20.0 110.855 -173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.9 pp -129.26 170.96 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.319 2.247 . . . . 20.0 110.817 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.67 -5.4 13.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.762 1.225 . . . . 20.0 112.018 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.6 -34.72 62.89 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.56 1.544 . . . . 20.0 113.131 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -138.34 -36.71 0.58 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.422 1.489 . . . . 20.0 111.855 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.6 p -90.12 48.47 1.57 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.079 1.752 . . . . 20.0 110.441 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -130.06 -7.68 4.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.635 1.974 . . . . 20.0 111.98 177.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.7 m -133.8 84.44 2.12 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.769 1.228 . . . . 20.0 111.354 -176.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.5 t -141.12 -55.72 0.49 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 155.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 160.6 -80.78 0.15 Allowed Glycine 0 C--N 1.341 0.861 0 CA-C-N 118.7 0.682 . . . . 20.0 112.175 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -80.24 65.3 5.35 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 126.443 1.897 . . . . 20.0 110.922 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 45.93 78.85 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 128.464 2.935 . . . . 20.0 112.443 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -63.68 133.84 54.32 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.448 -0.876 . . . . 20.0 109.204 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.477 ' HE2' ' HB2' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -142.39 130.64 22.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.115 0.966 . . . . 20.0 111.203 171.387 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.2 t -53.25 120.0 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.46 1.904 . . . . 20.0 111.722 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.9 t -158.97 85.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.743 0.817 . . . . 20.0 110.446 -172.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.56 10.67 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.406 1.082 . . . . 20.0 113.082 -174.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -84.52 178.64 7.63 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.688 1.595 . . . . 20.0 110.909 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.0 tt -84.91 -36.44 21.46 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.835 0.854 . . . . 20.0 110.987 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 . . . . . 0 C--O 1.249 1.059 0 C-N-CA 125.372 1.469 . . . . 20.0 109.714 -176.771 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 109.527 -0.546 . . . . 20.0 109.527 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.66 -38.63 91.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.285 0.634 . . . . 20.0 112.098 -175.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 t -61.31 -47.05 87.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.349 1.46 . . . . 20.0 111.871 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 88.8 t -77.58 -31.34 17.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.455 1.502 . . . . 20.0 111.411 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.2 m -63.7 -41.92 98.04 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.508 1.123 . . . . 20.0 111.738 173.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.55 -16.61 61.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.05 0.94 . . . . 20.0 112.879 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.64 52.67 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.786 1.184 . . . . 20.0 114.306 172.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -83.73 178.52 7.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.365 1.466 . . . . 20.0 112.321 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.52 175.26 15.67 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.493 1.521 . . . . 20.0 112.449 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.6 m -123.27 52.56 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.297 1.439 . . . . 20.0 111.144 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.65 153.04 88.47 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.008 0.923 . . . . 20.0 109.55 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.85 164.09 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.005 2.47 . . . . 20.0 111.63 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -62.42 -27.8 69.35 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.414 1.486 . . . . 20.0 111.229 172.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.6 m -64.66 -34.06 77.41 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 125.184 1.394 . . . . 20.0 112.473 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.37 -70.08 0.64 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.243 1.017 . . . . 20.0 110.518 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 m -69.94 144.22 92.8 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 124.168 0.987 . . . . 20.0 111.492 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.04 170.64 17.59 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.045 3.164 . . . . 20.0 111.781 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -70.44 -23.49 62.73 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.584 1.154 . . . . 20.0 113.218 -170.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -81.77 -36.88 28.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.265 2.226 . . . . 20.0 112.459 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.86 -8.07 52.14 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.928 1.291 . . . . 20.0 113.486 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -72.15 101.69 2.85 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.115 1.366 . . . . 20.0 110.813 -178.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.93 169.96 10.65 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.123 1.769 . . . . 20.0 111.742 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.6 p -98.17 -11.67 22.54 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.339 1.456 . . . . 20.0 113.743 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -69.42 163.62 24.84 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.437 1.095 . . . . 20.0 112.032 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.55 174.49 15.49 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.207 1.384 . . . . 20.0 111.849 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.29 -3.97 20.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.045 1.307 . . . . 20.0 113.787 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.32 179.41 5.89 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.263 1.425 . . . . 20.0 112.363 175.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -97.46 -13.67 21.61 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.64 1.176 . . . . 20.0 112.042 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -142.94 -71.07 0.32 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.761 1.624 . . . . 20.0 110.33 -173.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -159.1 145.29 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.461 1.104 . . . . 20.0 109.927 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.0 m -77.35 131.83 38.28 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.503 1.121 . . . . 20.0 109.702 169.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.6 t -124.32 118.8 27.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.623 1.169 . . . . 20.0 109.592 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.83 86.18 0.5 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.713 1.205 . . . . 20.0 112.536 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 mt -63.72 -30.97 72.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.517 1.127 . . . . 20.0 112.68 -178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.1 t -64.11 -34.77 78.81 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 123.919 0.888 . . . . 20.0 111.55 177.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -101.57 -1.12 33.63 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.304 1.042 . . . . 20.0 112.759 -174.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -79.84 -46.59 16.6 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.85 2.06 . . . . 20.0 110.43 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.1 t -78.48 172.68 13.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.78 1.632 . . . . 20.0 112.185 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.75 -118.39 1.41 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.796 1.665 . . . . 20.0 110.679 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -21.98 65.29 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.298 1.439 . . . . 20.0 113.618 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -55.98 -25.07 42.34 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.539 0.94 . . . . 20.0 113.539 169.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.97 82.39 0.32 Allowed Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.887 1.708 . . . . 20.0 110.386 175.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -77.79 -77.37 0.16 Allowed 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.211 1.404 . . . . 20.0 107.921 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.0 29.05 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.406 1.003 . . . . 20.0 113.012 -166.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.7 -125.14 3.05 Favored Glycine 0 C--N 1.343 0.942 0 C-N-CA 125.038 1.304 . . . . 20.0 111.513 -174.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.82 167.02 23.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.478 1.111 . . . . 20.0 112.653 -171.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 32.7 t -112.1 82.09 1.57 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.317 1.447 . . . . 20.0 109.937 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.6 164.64 36.63 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 126.04 1.736 . . . . 20.0 111.104 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.94 167.98 20.07 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.587 2.858 . . . . 20.0 112.921 -175.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.3 mt -64.63 -19.82 65.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.315 1.046 . . . . 20.0 112.65 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.29 -27.02 69.05 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.855 1.662 . . . . 20.0 111.926 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -70.46 127.84 34.11 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 125.021 1.328 . . . . 20.0 109.731 -177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -75.29 101.13 4.59 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.415 0.686 . . . . 20.0 110.247 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 p -160.97 -179.98 7.98 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.698 1.599 . . . . 20.0 111.194 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -59.38 165.54 2.72 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.715 2.006 . . . . 20.0 111.648 -177.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -139.44 128.55 23.81 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 125.855 1.662 . . . . 20.0 109.63 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.6 mt -150.79 115.29 5.16 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.422 1.889 . . . . 20.0 109.769 176.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -64.9 -18.93 65.63 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.529 0.936 . . . . 20.0 113.529 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.02 -17.21 60.55 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.964 1.305 . . . . 20.0 114.032 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -129.54 -49.99 1.16 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.707 1.203 . . . . 20.0 112.593 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.5 p -63.73 -18.59 64.19 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.025 1.12 . . . . 20.0 114.025 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.62 -13.5 42.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.467 1.507 . . . . 20.0 113.54 173.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 t -63.28 -46.03 88.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.522 1.129 . . . . 20.0 111.451 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -12.2 57.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.415 0.686 . . . . 20.0 112.539 169.095 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.61 -162.33 34.43 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.766 1.174 . . . . 20.0 112.664 178.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -74.83 46.46 0.29 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.511 1.924 . . . . 20.0 113.445 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.6 7.94 1.55 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 126.48 1.991 . . . . 20.0 112.528 173.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -144.86 161.74 38.56 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.848 1.259 . . . . 20.0 110.642 176.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.05 149.1 34.49 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.391 2.676 . . . . 20.0 108.444 173.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.6 t -52.64 109.0 0.35 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.854 0.862 . . . . 20.0 111.268 -173.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.36 18.29 13.68 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.154 0.982 . . . . 20.0 113.228 -167.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 t -138.64 116.76 12.73 Favored 'Isoleucine or valine' 0 C--N 1.343 0.3 0 C-N-CA 125.356 1.463 . . . . 20.0 107.995 -170.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -95.69 175.16 6.64 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.367 1.067 . . . . 20.0 110.858 175.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -60.65 2.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.671 0.788 . . . . 20.0 110.46 -171.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.9 t60 . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.836 1.654 . . . . 20.0 111.719 -178.858 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.881 0.372 . . . . 20.0 110.161 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -63.88 -37.62 88.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.629 1.572 . . . . 20.0 111.657 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -58.4 -54.78 43.11 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.324 1.45 . . . . 20.0 111.279 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 50.9 t -67.52 -34.4 68.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.119 1.368 . . . . 20.0 111.066 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.9 t -62.42 -41.48 98.72 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.101 1.361 . . . . 20.0 111.589 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -76.04 -14.02 60.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.609 1.164 . . . . 20.0 113.03 175.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.51 -2.03 53.41 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.781 1.658 . . . . 20.0 113.867 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -76.66 176.98 7.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.383 1.473 . . . . 20.0 111.714 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.79 176.45 18.16 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.886 1.232 . . . . 20.0 111.986 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -124.82 76.39 1.51 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.775 1.23 . . . . 20.0 108.702 172.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -77.53 156.1 81.0 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.339 1.056 . . . . 20.0 109.534 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.94 160.13 51.09 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.5 2.134 . . . . 20.0 111.34 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -64.75 -20.85 66.59 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.986 0.914 . . . . 20.0 112.715 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.0 t -68.11 -55.72 11.45 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.017 0.927 . . . . 20.0 110.896 172.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.03 -54.97 9.3 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.45 1.1 . . . . 20.0 111.775 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 t -62.35 115.86 19.02 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.363 1.065 . . . . 20.0 110.889 -177.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -69.04 156.45 65.18 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.785 2.323 . . . . 20.0 110.592 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -72.84 -17.0 61.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.819 0.848 . . . . 20.0 112.977 -166.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -72.61 -40.91 66.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.288 2.635 . . . . 20.0 111.97 173.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.37 -10.68 59.75 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.036 1.334 . . . . 20.0 112.937 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -66.46 119.5 11.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.202 1.001 . . . . 20.0 110.78 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -90.54 172.82 8.43 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.025 1.33 . . . . 20.0 110.715 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 t -87.54 -14.79 39.28 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.809 1.244 . . . . 20.0 112.204 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -63.64 165.34 8.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.408 1.483 . . . . 20.0 112.538 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.83 -168.77 11.9 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.177 1.37 . . . . 20.0 113.343 -171.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.2 -11.11 73.12 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.224 1.869 . . . . 20.0 113.421 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 77.2 m -67.17 172.23 4.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.62 1.168 . . . . 20.0 111.748 174.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.2 p -106.33 -5.77 18.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.097 1.759 . . . . 20.0 113.533 173.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -139.36 -72.64 0.39 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.266 1.827 . . . . 20.0 109.993 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -164.11 155.32 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.982 1.713 . . . . 20.0 109.002 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -76.02 160.02 30.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.883 0.873 . . . . 20.0 110.403 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.95 117.97 5.9 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.952 0.501 . . . . 20.0 110.825 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -71.74 93.74 1.31 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.805 1.242 . . . . 20.0 110.377 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.95 -22.28 64.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.452 1.101 . . . . 20.0 112.888 -177.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.0 t -74.14 -15.52 61.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.746 1.218 . . . . 20.0 113.023 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -129.25 9.0 5.6 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.767 1.627 . . . . 20.0 113.243 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tt -76.5 -54.12 7.15 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.772 1.229 . . . . 20.0 109.645 173.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 p -104.67 175.65 5.42 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.138 1.775 . . . . 20.0 111.599 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -160.54 -127.02 0.86 Allowed Glycine 0 C--N 1.343 0.96 0 C-N-CA 124.76 1.172 . . . . 20.0 111.123 -175.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.6 t -70.83 -67.5 0.5 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.144 0.978 . . . . 20.0 111.16 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -133.34 -49.58 0.85 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.817 1.247 . . . . 20.0 112.593 -162.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.28 -61.56 0.01 OUTLIER Glycine 0 C--N 1.344 1.005 0 C-N-CA 124.219 0.914 . . . . 20.0 113.0 -179.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -68.21 -44.82 74.94 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.378 1.471 . . . . 20.0 111.819 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 151.23 -25.25 0.99 Allowed Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.456 1.503 . . . . 20.0 112.881 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 98.86 156.57 29.24 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.637 1.589 . . . . 20.0 111.192 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -137.42 136.02 37.45 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 125.159 1.383 . . . . 20.0 109.34 -179.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.8 m -82.56 94.89 7.6 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.405 0.682 . . . . 20.0 109.518 174.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.63 154.7 60.12 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 125.809 1.643 . . . . 20.0 110.858 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -68.39 156.48 65.49 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.676 2.917 . . . . 20.0 112.362 -170.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.91 -19.84 65.8 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.595 0.758 . . . . 20.0 112.665 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -69.04 -27.02 65.27 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.929 1.692 . . . . 20.0 112.577 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -76.38 134.32 39.68 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.335 0.654 . . . . 20.0 109.993 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.15 99.22 0.87 Allowed 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.631 1.172 . . . . 20.0 110.157 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.33 173.43 8.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.866 1.266 . . . . 20.0 111.472 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -68.25 166.95 15.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.534 1.133 . . . . 20.0 111.439 177.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -142.95 140.19 31.0 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.188 1.795 . . . . 20.0 109.447 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.48 87.75 1.74 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.354 1.461 . . . . 20.0 111.337 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -68.18 -9.57 47.79 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.749 1.018 . . . . 20.0 113.749 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.43 -7.62 40.97 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.547 1.539 . . . . 20.0 113.534 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.25 -56.78 0.65 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.922 1.289 . . . . 20.0 111.047 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 t -66.27 -20.55 66.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.221 1.408 . . . . 20.0 113.184 -176.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.63 -6.65 1.21 Allowed 'General case' 0 C--N 1.344 0.365 0 C-N-CA 126.966 2.106 . . . . 20.0 114.963 -178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.1 t -54.58 -28.84 48.97 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.391 0.996 . . . . 20.0 113.362 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.4 -75.69 0.12 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.22 1.008 . . . . 20.0 109.142 165.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 145.13 -62.64 0.47 Allowed Glycine 0 C--N 1.347 1.144 0 C-N-CA 123.918 0.771 . . . . 20.0 112.463 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 144.12 50.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.982 1.313 . . . . 20.0 110.291 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 55.59 46.92 80.19 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.037 1.303 . . . . 20.0 113.069 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -127.5 -0.11 6.23 Favored 'General case' 0 C--N 1.347 0.471 0 N-CA-C 118.837 2.902 . . . . 20.0 118.837 -165.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -41.15 127.3 2.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.113 2.165 . . . . 20.0 113.981 -168.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 44.4 t -60.49 111.93 1.78 Allowed 'General case' 0 C--N 1.345 0.388 0 C-N-CA 123.904 0.881 . . . . 20.0 109.751 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.6 t -130.17 83.43 2.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.957 1.303 . . . . 20.0 108.332 -174.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.9 t -116.23 131.3 69.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.016 1.727 . . . . 20.0 108.276 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -94.47 174.89 6.9 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.924 1.29 . . . . 20.0 110.637 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 74' ' ' LEU . 2.5 pt? -78.51 177.39 8.58 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.721 -0.672 . . . . 20.0 111.927 172.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 t60 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 117.4 -1.286 . . . . 20.0 111.54 178.293 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 121.2 0.524 . . . . 20.0 111.015 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -59.67 -35.98 75.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.02 1.328 . . . . 20.0 112.964 -175.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.7 t -63.4 -35.99 82.23 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.473 1.109 . . . . 20.0 111.895 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.4 t -76.74 -41.95 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.376 1.47 . . . . 20.0 110.634 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.6 m -62.17 -38.65 89.87 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.88 1.272 . . . . 20.0 112.743 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -71.67 -15.94 62.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.736 1.214 . . . . 20.0 113.085 175.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.67 -1.07 56.77 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 125.211 1.386 . . . . 20.0 114.535 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -74.59 176.71 6.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.465 1.132 . . . . 20.0 111.333 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 178.65 19.18 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.049 1.309 . . . . 20.0 112.57 -176.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -131.63 68.31 1.5 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.383 1.473 . . . . 20.0 109.67 176.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.54 155.75 87.88 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 109.238 -0.653 . . . . 20.0 109.238 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.79 166.7 28.7 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.7 2.267 . . . . 20.0 111.018 174.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -63.64 -22.49 66.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.602 0.761 . . . . 20.0 111.753 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -74.04 -16.39 61.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.434 1.494 . . . . 20.0 113.899 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -126.1 -37.92 2.21 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.894 1.278 . . . . 20.0 112.597 -174.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -71.22 125.89 91.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 123.861 0.864 . . . . 20.0 110.039 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -69.12 153.53 71.74 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.688 2.258 . . . . 20.0 109.752 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -73.44 -14.4 61.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.361 1.065 . . . . 20.0 112.955 -167.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -76.56 -42.08 44.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.693 2.397 . . . . 20.0 112.226 174.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.9 -11.5 59.82 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.808 1.243 . . . . 20.0 113.577 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -67.34 108.07 2.63 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.301 1.04 . . . . 20.0 111.127 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.6 mt -76.07 172.39 12.86 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.883 1.273 . . . . 20.0 112.334 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 55.9 m -90.51 -11.22 40.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.192 1.397 . . . . 20.0 112.953 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -71.71 175.06 6.0 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.799 1.24 . . . . 20.0 112.96 -176.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.21 177.52 18.17 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.524 1.535 . . . . 20.0 112.681 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.34 -11.06 26.36 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.972 1.749 . . . . 20.0 113.373 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.2 m -74.67 178.36 5.47 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.395 1.478 . . . . 20.0 112.263 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 m -115.55 -5.17 12.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.164 1.386 . . . . 20.0 112.322 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -138.75 -74.63 0.38 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.683 1.993 . . . . 20.0 109.204 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -161.1 158.83 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 126.636 1.974 . . . . 20.0 108.271 179.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 31.8 m -75.18 163.07 27.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.808 0.843 . . . . 20.0 111.358 171.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.87 118.66 5.77 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.194 0.997 . . . . 20.0 110.084 170.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -69.3 100.45 1.34 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.811 1.245 . . . . 20.0 109.547 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 mt -67.95 -24.95 65.23 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.318 1.047 . . . . 20.0 112.267 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.8 t -74.93 -5.7 45.21 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.153 1.381 . . . . 20.0 112.499 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -121.22 10.04 10.56 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.934 1.694 . . . . 20.0 111.981 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 tp -106.76 -37.67 6.33 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.974 1.71 . . . . 20.0 111.043 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 65.0 p -122.48 150.14 42.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.547 1.939 . . . . 20.0 110.887 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.68 172.58 32.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.866 1.222 . . . . 20.0 113.001 -178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.1 m -81.17 -42.07 21.41 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.8 1.24 . . . . 20.0 111.933 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -137.4 -31.03 0.82 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.66 1.584 . . . . 20.0 112.139 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.8 67.85 0.8 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 124.936 1.255 . . . . 20.0 110.703 -176.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -131.38 -65.87 0.75 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.942 2.097 . . . . 20.0 108.72 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.56 -49.03 0.02 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.838 1.209 . . . . 20.0 111.705 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.39 101.11 0.69 Allowed Glycine 0 C--N 1.342 0.89 0 C-N-CA 124.454 1.026 . . . . 20.0 111.271 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.18 150.31 47.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.872 0.869 . . . . 20.0 111.472 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.4 t -110.87 28.66 8.49 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.821 1.648 . . . . 20.0 111.711 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -45.14 149.8 0.86 Allowed Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 127.809 2.444 . . . . 20.0 113.821 159.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.88 159.45 41.73 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.12 3.213 . . . . 20.0 112.84 -171.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.33 -18.78 64.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.332 1.053 . . . . 20.0 113.759 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.09 -29.8 67.97 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.994 1.318 . . . . 20.0 112.624 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.442 ' HB3' ' HZ2' ' A' ' 69' ' ' LYS . 2.9 tpt180 -73.06 138.91 46.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.571 0.748 . . . . 20.0 110.664 -175.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -71.73 104.27 3.34 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.204 1.401 . . . . 20.0 111.329 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -163.5 177.99 8.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.034 1.734 . . . . 20.0 110.077 173.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -69.0 162.49 26.71 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.653 1.181 . . . . 20.0 110.814 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -148.32 134.76 19.62 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.785 1.234 . . . . 20.0 109.978 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.8 mt -146.18 110.91 5.19 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 126.594 1.958 . . . . 20.0 108.729 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.95 -21.67 66.24 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.114 0.783 . . . . 20.0 113.114 -176.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.05 -35.74 74.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.429 1.092 . . . . 20.0 112.185 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -108.24 -31.19 7.99 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.881 1.273 . . . . 20.0 111.89 -170.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.8 p -84.1 -4.8 59.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.283 1.433 . . . . 20.0 113.828 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.3 -9.1 37.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.454 1.102 . . . . 20.0 113.012 174.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.7 t -60.86 -56.34 22.28 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.529 1.532 . . . . 20.0 112.258 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -79.31 -12.45 59.93 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.805 0.73 . . . . 20.0 112.184 172.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.19 -164.81 44.43 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.741 1.162 . . . . 20.0 112.588 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -54.76 107.56 0.3 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.096 1.758 . . . . 20.0 111.635 177.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 134.18 -17.7 4.29 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.288 1.423 . . . . 20.0 112.824 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -110.59 147.99 33.09 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-N 118.967 1.383 . . . . 20.0 111.017 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.442 ' HZ2' ' HB3' ' A' ' 52' ' ' ARG . 0.6 OUTLIER -132.17 153.81 50.18 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.141 1.777 . . . . 20.0 109.706 175.269 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.2 t -66.89 96.77 0.44 Allowed 'General case' 0 C--N 1.346 0.443 0 C-N-CA 124.581 1.152 . . . . 20.0 110.92 -176.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 10.8 t -143.39 111.49 6.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.073 1.349 . . . . 20.0 109.811 -176.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.2 p -148.12 157.97 8.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.049 0.94 . . . . 20.0 110.302 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -130.88 178.81 6.38 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.429 1.492 . . . . 20.0 109.965 174.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -102.02 -14.55 17.1 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.393 1.077 . . . . 20.0 111.671 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.7 m80 . . . . . 0 C--O 1.25 1.104 0 C-N-CA 126.715 2.006 . . . . 20.0 109.255 178.906 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 120.884 0.373 . . . . 20.0 110.518 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -122.27 -38.58 2.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.646 1.978 . . . . 20.0 110.476 -175.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 m -68.64 -27.57 66.12 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.98 1.712 . . . . 20.0 112.774 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.2 -53.3 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.175 1.39 . . . . 20.0 109.981 169.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 t -61.77 -33.53 74.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.237 1.015 . . . . 20.0 112.274 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -72.91 -56.77 4.7 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.566 1.146 . . . . 20.0 110.561 173.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.22 53.07 0.4 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.497 1.522 . . . . 20.0 112.978 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -116.98 179.71 3.94 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.671 1.589 . . . . 20.0 111.396 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.28 168.4 19.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.218 0.914 . . . . 20.0 112.697 -175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.8 m -120.58 83.93 2.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.235 1.414 . . . . 20.0 108.897 174.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -98.78 155.65 36.45 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.669 1.188 . . . . 20.0 108.468 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.86 162.15 42.83 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.652 2.235 . . . . 20.0 111.184 173.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -62.23 -28.42 69.68 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.7 1.2 . . . . 20.0 111.329 173.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -73.2 -16.14 61.43 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.719 1.208 . . . . 20.0 113.818 175.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -97.39 -66.27 0.91 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.415 1.086 . . . . 20.0 110.34 175.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.6 m -72.0 143.18 86.11 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.876 0.87 . . . . 20.0 111.234 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.21 173.38 13.09 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 124.384 3.389 . . . . 20.0 111.178 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -74.04 7.77 2.47 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.564 1.546 . . . . 20.0 113.841 -172.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -123.54 -38.13 2.57 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.624 1.97 . . . . 20.0 112.699 -172.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.59 -15.4 63.41 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.339 1.056 . . . . 20.0 113.304 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.77 109.86 3.54 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 126.118 1.767 . . . . 20.0 110.421 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.35 169.58 17.37 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.393 1.477 . . . . 20.0 111.683 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -103.22 -6.64 21.9 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.103 1.361 . . . . 20.0 112.813 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.44 176.07 1.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.881 1.672 . . . . 20.0 111.215 167.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.34 174.49 22.85 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 123.865 0.745 . . . . 20.0 113.6 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.03 -4.42 20.5 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 126.182 1.849 . . . . 20.0 114.384 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.3 m -73.22 -177.52 2.56 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.68 1.24 . . . . 20.0 111.471 165.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.1 m -99.52 -10.69 21.82 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.813 0.845 . . . . 20.0 111.899 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.4 p -138.95 -70.68 0.41 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.955 1.702 . . . . 20.0 109.513 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -157.47 144.37 9.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.117 1.367 . . . . 20.0 109.186 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.45 132.92 35.34 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.482 0.713 . . . . 20.0 109.619 173.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.8 t -126.19 114.93 18.98 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.961 1.304 . . . . 20.0 109.613 -174.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -67.38 99.83 0.77 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 124.788 1.235 . . . . 20.0 110.106 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.4 mt -68.73 -27.89 66.33 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.303 1.041 . . . . 20.0 112.149 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -72.98 -10.12 59.46 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.053 1.341 . . . . 20.0 112.957 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -121.58 21.88 10.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.613 1.565 . . . . 20.0 111.175 174.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.82 -59.46 1.96 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.313 1.845 . . . . 20.0 108.295 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 76.5 p -90.95 156.51 17.92 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.085 1.354 . . . . 20.0 111.165 178.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 142.05 -176.73 21.92 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.4 1.476 . . . . 20.0 111.581 -175.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.61 -25.6 64.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.044 0.937 . . . . 20.0 112.76 171.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -61.05 -12.26 11.25 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.776 1.63 . . . . 20.0 114.0 169.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -70.26 -87.5 0.11 Allowed Glycine 0 C--N 1.342 0.907 0 C-N-CA 125.604 1.574 . . . . 20.0 111.148 178.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.5 -53.59 5.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.175 0.99 . . . . 20.0 110.173 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 161.63 -15.79 0.16 Allowed Glycine 0 CA--C 1.534 1.277 0 CA-C-O 118.63 -1.094 . . . . 20.0 114.468 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.98 176.4 37.98 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.618 1.209 . . . . 20.0 113.449 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -145.59 157.64 43.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.61 1.164 . . . . 20.0 110.924 177.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.5 t -86.62 22.5 1.89 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.422 2.289 . . . . 20.0 112.127 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -58.93 148.91 68.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.893 1.277 . . . . 20.0 111.049 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.75 166.09 28.75 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 124.242 3.295 . . . . 20.0 113.469 -166.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.72 -23.85 65.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.378 1.071 . . . . 20.0 112.605 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -71.92 -13.03 61.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.261 1.424 . . . . 20.0 113.085 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.3 tpt85 -78.71 153.52 30.82 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.518 1.127 . . . . 20.0 110.269 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -102.68 101.63 11.76 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.533 1.133 . . . . 20.0 109.443 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 p -169.63 161.44 9.43 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.176 1.79 . . . . 20.0 111.077 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -80.88 110.14 16.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.087 1.755 . . . . 20.0 111.447 -173.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -79.6 151.41 30.63 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.46 0.704 . . . . 20.0 110.573 168.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.79 16.48 2.5 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.895 1.678 . . . . 20.0 114.54 175.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 51.85 21.37 1.42 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 130.251 3.42 . . . . 20.0 116.989 169.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -129.3 -71.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.271 1.429 . . . . 20.0 110.402 -167.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -63.47 -36.69 84.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 20.0 111.23 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.2 t -69.12 -32.03 71.15 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.18 1.792 . . . . 20.0 113.441 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.35 -7.06 16.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.009 1.324 . . . . 20.0 114.341 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.8 m -59.65 -42.6 93.16 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.227 1.411 . . . . 20.0 111.844 171.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 19.4 m -79.13 -11.47 59.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.839 1.256 . . . . 20.0 113.331 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 88.57 -98.83 2.47 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 125.319 1.438 . . . . 20.0 111.467 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -132.08 161.5 33.1 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.749 1.619 . . . . 20.0 110.588 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.63 -8.3 74.31 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.965 1.269 . . . . 20.0 113.598 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -123.75 178.61 5.15 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.849 1.66 . . . . 20.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -146.18 162.89 37.02 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.134 1.774 . . . . 20.0 110.537 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.65 123.27 17.45 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 107.738 -1.208 . . . . 20.0 107.738 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.1 t -140.03 105.83 5.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.272 0.629 . . . . 20.0 109.875 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.3 p -145.36 146.96 19.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.981 1.312 . . . . 20.0 109.345 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -112.39 177.21 4.72 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.263 1.425 . . . . 20.0 110.857 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.2 tp -82.01 -169.82 2.57 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.462 1.105 . . . . 20.0 110.543 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 126.079 1.751 . . . . 20.0 113.854 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 20.1 p30 . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.772 0.32 . . . . 20.0 111.344 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -121.6 -42.99 2.4 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.861 1.264 . . . . 20.0 111.487 -177.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.2 m -61.92 -34.89 76.89 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.477 0.711 . . . . 20.0 111.392 176.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.29 -49.55 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.282 1.433 . . . . 20.0 110.367 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 t -63.89 -33.41 75.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.98 1.312 . . . . 20.0 112.455 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -82.4 -8.25 59.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.52 1.528 . . . . 20.0 113.104 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.29 15.32 41.69 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.558 1.075 . . . . 20.0 114.512 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -100.34 -177.57 3.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.052 1.741 . . . . 20.0 111.695 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.3 170.08 15.62 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.28 1.419 . . . . 20.0 112.525 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.6 m -113.62 78.84 1.18 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.006 1.322 . . . . 20.0 109.834 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.13 156.78 74.07 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.972 0.909 . . . . 20.0 109.491 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.05 161.65 45.19 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.771 2.314 . . . . 20.0 110.694 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -64.06 -29.92 71.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.898 0.879 . . . . 20.0 111.17 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 t -62.66 -36.15 81.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.613 1.165 . . . . 20.0 112.542 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -86.89 -58.09 2.73 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.943 0.897 . . . . 20.0 111.047 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.9 t -67.42 118.48 57.1 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.955 1.302 . . . . 20.0 110.978 -176.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -71.46 162.25 42.9 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.321 2.681 . . . . 20.0 110.845 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.52 -14.69 61.26 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.427 1.091 . . . . 20.0 113.461 -166.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.38 -34.04 65.34 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 128.226 2.61 . . . . 20.0 112.244 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.12 -6.43 38.44 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.197 1.799 . . . . 20.0 114.104 -173.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.52 105.53 3.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.079 0.951 . . . . 20.0 110.434 177.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.36 169.44 12.31 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.494 . . . . 20.0 111.808 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.3 t -93.8 -15.04 25.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.781 1.233 . . . . 20.0 112.677 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.9 m-85 -63.57 170.61 3.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.703 1.601 . . . . 20.0 111.491 170.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -147.25 -178.65 22.69 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.134 0.874 . . . . 20.0 113.587 -176.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.66 -13.18 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.627 2.061 . . . . 20.0 113.65 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 87.8 m -69.32 176.29 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.57 1.548 . . . . 20.0 112.909 179.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.3 t -90.64 -15.68 30.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.65 0.78 . . . . 20.0 111.077 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.4 p -137.69 -74.78 0.41 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 20.0 109.65 -176.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -161.98 161.06 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.236 1.814 . . . . 20.0 108.525 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.8 m -92.29 162.55 14.24 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.435 0.694 . . . . 20.0 110.965 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -146.85 121.15 9.58 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.013 0.925 . . . . 20.0 109.378 177.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -70.79 92.74 0.91 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.944 0.897 . . . . 20.0 111.563 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -64.11 -30.26 71.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.842 1.257 . . . . 20.0 112.485 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.7 p -71.23 -7.72 48.74 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.943 1.697 . . . . 20.0 113.507 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -123.54 1.52 8.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.387 1.475 . . . . 20.0 112.862 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.03 -56.3 2.53 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.205 1.802 . . . . 20.0 109.357 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 48.1 p -61.27 167.11 3.35 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.873 2.069 . . . . 20.0 113.743 -175.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.75 -102.37 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.771 1.653 . . . . 20.0 109.782 175.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.04 -41.53 61.64 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.045 0.938 . . . . 20.0 113.065 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 ttmp? -142.9 -73.65 0.29 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.474 1.109 . . . . 20.0 110.614 -175.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.6 -67.48 0.06 OUTLIER Glycine 0 C--N 1.34 0.791 0 C-N-CA 125.18 1.371 . . . . 20.0 110.818 -174.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -71.17 -13.99 62.12 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.535 1.534 . . . . 20.0 113.852 174.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.1 -22.37 36.9 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.612 1.577 . . . . 20.0 114.012 174.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.67 173.97 43.73 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.677 1.608 . . . . 20.0 114.183 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -138.16 169.06 18.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.144 1.378 . . . . 20.0 112.99 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 12.0 t -95.8 33.91 1.6 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.032 2.133 . . . . 20.0 112.164 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.44 156.11 44.05 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.633 1.573 . . . . 20.0 112.895 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.46 159.42 44.4 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.711 3.607 . . . . 20.0 112.08 -171.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.2 -21.14 64.88 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.019 1.328 . . . . 20.0 112.518 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.29 -25.33 66.8 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.743 1.617 . . . . 20.0 112.836 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.55 150.97 42.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.817 1.247 . . . . 20.0 110.536 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -134.02 102.47 5.43 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.906 1.282 . . . . 20.0 109.188 -179.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.39 -87.73 0.08 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.444 1.897 . . . . 20.0 107.739 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -146.57 165.82 28.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.203 1.801 . . . . 20.0 109.302 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.96 163.53 32.72 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.977 0.911 . . . . 20.0 111.238 170.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.2 tp -169.23 109.92 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 107.498 -1.297 . . . . 20.0 107.498 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -67.1 -18.93 65.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.305 1.442 . . . . 20.0 114.147 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.7 -27.7 66.67 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.005 1.113 . . . . 20.0 114.005 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -127.5 -30.56 2.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.767 1.227 . . . . 20.0 111.832 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 54.7 p -70.46 -22.65 62.66 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.894 1.072 . . . . 20.0 113.894 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.28 -6.38 6.79 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.617 1.567 . . . . 20.0 114.412 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m -126.45 67.81 1.23 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.552 1.541 . . . . 20.0 109.401 167.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.86 -27.72 2.06 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.002 1.321 . . . . 20.0 113.934 171.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.62 -92.15 0.23 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 124.836 1.207 . . . . 20.0 111.923 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -77.13 41.33 0.29 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.97 2.108 . . . . 20.0 112.828 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.72 60.07 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 C-N-CA 123.75 0.69 . . . . 20.0 113.429 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -86.03 79.76 9.07 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 123.069 1.414 . . . . 20.0 111.314 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.66 119.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 128.395 2.678 . . . . 20.0 110.031 166.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -72.72 88.37 1.29 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.056 0.455 . . . . 20.0 110.807 176.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 26.4 t -81.53 132.77 35.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.459 1.904 . . . . 20.0 110.263 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.2 p -153.48 162.2 2.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.523 0.729 . . . . 20.0 110.379 174.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -129.03 178.31 6.49 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.969 1.707 . . . . 20.0 111.066 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.95 -175.71 1.52 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.206 1.402 . . . . 20.0 111.946 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.8 p80 . . . . . 0 C--O 1.251 1.162 0 C-N-CA 126.124 1.769 . . . . 20.0 113.849 -176.443 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.3 p30 . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 111.468 0.173 . . . . 20.0 111.468 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -121.96 -51.37 2.02 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.624 1.169 . . . . 20.0 110.3 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.7 m -62.74 -36.47 83.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.708 1.203 . . . . 20.0 111.523 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.14 -43.49 95.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.508 1.523 . . . . 20.0 110.013 174.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 t -62.6 -38.41 90.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.082 0.953 . . . . 20.0 111.839 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -70.75 -30.07 66.48 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.484 1.114 . . . . 20.0 112.16 176.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.72 -2.23 23.17 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.771 1.653 . . . . 20.0 114.619 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -71.98 -179.15 2.63 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.349 1.86 . . . . 20.0 112.277 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.81 171.9 18.43 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 124.785 1.184 . . . . 20.0 113.195 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -113.2 82.35 1.65 Allowed 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.68 1.592 . . . . 20.0 109.837 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -86.64 156.04 56.12 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.408 1.083 . . . . 20.0 109.253 173.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.31 164.69 34.88 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.741 2.294 . . . . 20.0 110.809 170.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -64.52 -25.61 68.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.757 1.223 . . . . 20.0 112.013 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 t -69.59 -36.39 76.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.287 1.035 . . . . 20.0 112.124 177.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -86.62 -52.84 5.3 Favored 'General case' 0 C--N 1.344 0.349 0 C-N-CA 124.151 0.98 . . . . 20.0 111.475 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.1 t -67.2 119.33 63.93 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 124.36 1.064 . . . . 20.0 110.497 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -69.45 158.42 57.43 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.807 2.338 . . . . 20.0 110.321 175.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -73.44 -16.34 61.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.357 1.063 . . . . 20.0 112.878 -165.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.55 -40.75 48.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.597 2.359 . . . . 20.0 111.772 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.23 -4.71 51.93 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.872 1.669 . . . . 20.0 113.833 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.94 107.9 5.57 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 124.275 1.03 . . . . 20.0 110.84 -179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.04 170.65 10.95 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.911 1.684 . . . . 20.0 112.196 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 t -99.78 -11.11 21.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.571 1.548 . . . . 20.0 112.55 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -65.24 174.61 1.98 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.226 1.811 . . . . 20.0 111.306 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.92 176.75 25.64 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.669 0.652 . . . . 20.0 113.406 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.07 -12.71 17.03 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.136 1.826 . . . . 20.0 113.862 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -69.01 175.86 3.49 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.725 1.262 . . . . 20.0 112.323 173.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.6 p -85.07 -22.85 28.8 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 124.529 1.132 . . . . 20.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 p -140.9 -67.71 0.41 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.086 1.354 . . . . 20.0 110.297 -170.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.7 147.47 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 125.179 1.392 . . . . 20.0 109.862 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.9 m -87.32 131.02 34.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.741 1.216 . . . . 20.0 110.129 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 t -124.6 127.55 47.54 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.517 1.127 . . . . 20.0 109.701 -174.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -76.75 80.95 3.36 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.903 0.881 . . . . 20.0 113.3 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.62 -26.82 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.531 1.532 . . . . 20.0 113.95 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.6 m -67.3 -18.68 65.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.347 1.059 . . . . 20.0 113.048 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -136.12 7.25 3.14 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.78 1.632 . . . . 20.0 113.545 -176.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 tp -67.82 -45.38 74.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.192 1.397 . . . . 20.0 110.65 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -113.61 -70.48 0.8 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.363 1.465 . . . . 20.0 111.271 -171.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -161.23 -164.66 16.53 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.951 0.786 . . . . 20.0 112.89 -172.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.0 m -47.5 -56.48 6.98 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.368 1.867 . . . . 20.0 111.339 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.4 tttt 58.99 15.6 4.08 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 127.002 2.121 . . . . 20.0 114.955 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.3 -65.88 2.58 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.561 1.553 . . . . 20.0 113.174 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -125.91 -24.89 3.7 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.839 1.256 . . . . 20.0 113.779 -174.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 137.61 20.3 0.55 Allowed Glycine 0 CA--C 1.53 0.998 0 CA-C-O 118.805 -0.997 . . . . 20.0 114.185 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.61 -161.19 3.68 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.536 1.541 . . . . 20.0 113.986 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -139.82 140.62 36.65 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.153 1.381 . . . . 20.0 110.593 -172.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.43 122.25 32.45 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.559 0.744 . . . . 20.0 109.956 165.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -137.45 154.97 75.68 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.81 2.044 . . . . 20.0 110.035 173.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.81 164.99 19.76 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.724 3.616 . . . . 20.0 114.409 -165.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.23 -15.04 30.53 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.163 1.385 . . . . 20.0 113.834 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -88.91 -6.55 57.22 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.425 1.49 . . . . 20.0 113.922 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -67.28 -22.26 65.66 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.588 1.155 . . . . 20.0 114.107 -170.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 67.06 1.8 2.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.458 1.903 . . . . 20.0 114.525 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -63.58 -87.83 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.26 1.824 . . . . 20.0 112.207 -175.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -153.79 161.45 42.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.634 1.974 . . . . 20.0 109.121 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -128.24 141.23 51.52 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.781 2.032 . . . . 20.0 109.684 176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 68.0 mt -139.7 105.22 5.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.518 1.927 . . . . 20.0 108.889 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -63.54 -20.85 65.96 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.822 1.192 . . . . 20.0 113.46 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.06 -15.96 60.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.814 1.246 . . . . 20.0 113.983 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -129.83 -44.88 1.18 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.712 1.205 . . . . 20.0 112.138 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 m -66.47 -28.98 69.01 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 125.202 1.401 . . . . 20.0 113.228 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.11 -14.97 58.53 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.4 . . . . 20.0 112.992 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.4 m -68.44 -51.02 48.26 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 125.533 1.533 . . . . 20.0 111.616 173.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 23.3 m -69.1 -26.75 65.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.922 0.889 . . . . 20.0 111.517 169.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.24 -179.06 19.36 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.729 1.633 . . . . 20.0 113.278 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.33 45.3 0.37 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.282 2.633 . . . . 20.0 113.194 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -143.49 -2.72 0.91 Allowed Glycine 0 CA--C 1.535 1.311 0 C-N-CA 126.972 2.225 . . . . 20.0 113.018 176.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -135.87 171.21 14.79 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.048 1.424 . . . . 20.0 111.297 176.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -144.34 120.44 10.77 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.308 2.243 . . . . 20.0 110.509 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -81.09 125.49 30.28 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.262 1.425 . . . . 20.0 112.027 -165.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 35.8 m -71.99 -12.58 61.3 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 115.006 1.484 . . . . 20.0 115.006 -179.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 p -71.52 171.75 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.454 1.101 . . . . 20.0 112.069 -173.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -123.02 178.74 4.93 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.912 1.685 . . . . 20.0 111.083 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.6 mt -126.65 159.33 33.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.923 1.689 . . . . 20.0 110.261 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . 0.263 44.6 p-80 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 128.885 2.874 . . . . 20.0 114.168 -170.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.939 -0.393 . . . . 20.0 109.939 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.84 -39.66 93.93 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.849 0.86 . . . . 20.0 112.593 -173.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -63.79 -33.9 76.7 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.993 . . . . 20.0 111.754 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -42.6 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 125.274 1.43 . . . . 20.0 110.843 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 t -59.52 -45.03 92.93 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.864 1.666 . . . . 20.0 111.889 -177.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -69.06 -13.06 62.22 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.808 1.243 . . . . 20.0 113.443 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.28 5.75 57.95 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 125.4 1.476 . . . . 20.0 114.036 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -81.01 177.29 9.15 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.271 1.028 . . . . 20.0 112.011 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.97 177.05 18.0 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.235 1.398 . . . . 20.0 112.222 -174.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.4 m -131.24 71.91 1.49 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.922 1.289 . . . . 20.0 110.27 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.87 159.21 83.52 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.832 1.253 . . . . 20.0 109.696 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.73 161.04 47.48 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.391 2.061 . . . . 20.0 110.65 172.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.61 -21.47 66.72 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.0 0.92 . . . . 20.0 111.779 176.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.4 m -71.01 -17.98 62.61 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.541 1.536 . . . . 20.0 114.167 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.76 -46.12 2.66 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.558 1.143 . . . . 20.0 111.319 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.4 t -66.61 119.03 59.93 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 123.53 0.732 . . . . 20.0 110.537 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -71.33 161.25 46.29 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.327 2.684 . . . . 20.0 110.477 175.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -76.12 -13.5 60.2 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.416 0.895 . . . . 20.0 113.416 -166.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.07 -42.76 62.72 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.701 2.4 . . . . 20.0 111.794 171.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.72 -9.46 59.43 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.231 1.413 . . . . 20.0 113.482 -175.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.68 102.77 2.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.805 1.242 . . . . 20.0 111.33 -177.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 mt -75.57 167.12 22.5 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.872 1.269 . . . . 20.0 112.166 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -87.67 -12.14 46.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 20.0 112.773 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.89 170.39 11.26 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.744 1.217 . . . . 20.0 111.912 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.12 177.76 17.23 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.113 1.34 . . . . 20.0 112.669 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.03 -8.63 25.23 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.854 1.692 . . . . 20.0 113.53 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.0 m -77.52 175.83 9.47 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.555 1.142 . . . . 20.0 112.42 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -114.2 -5.06 13.02 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.317 1.447 . . . . 20.0 111.99 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.8 p -137.33 -71.83 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.998 1.719 . . . . 20.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -163.65 153.18 2.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.084 1.754 . . . . 20.0 109.42 177.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.94 157.32 38.38 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.853 0.861 . . . . 20.0 111.823 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -153.29 119.1 5.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.009 0.924 . . . . 20.0 110.185 174.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -71.76 90.51 1.09 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.017 0.927 . . . . 20.0 112.587 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.93 -37.61 82.91 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.66 1.184 . . . . 20.0 112.681 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.2 p -73.84 -5.54 41.56 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.872 1.269 . . . . 20.0 113.774 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mtmt -129.9 5.93 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.505 1.522 . . . . 20.0 113.116 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.7 tp -69.22 -49.14 59.18 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 126.083 1.753 . . . . 20.0 112.03 -170.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 28.46 81.9 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.302 3.041 . . . . 20.0 113.656 -175.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -161.69 164.58 35.27 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 125.246 1.403 . . . . 20.0 111.983 177.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -42.15 70.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.795 0.838 . . . . 20.0 112.412 -170.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -67.51 -14.95 63.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.306 1.042 . . . . 20.0 113.16 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.4 -20.47 58.82 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 125.08 1.324 . . . . 20.0 114.2 175.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -124.32 -22.74 4.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.749 2.02 . . . . 20.0 111.518 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.13 68.54 1.46 Allowed Glycine 0 C--N 1.343 0.936 0 N-CA-C 109.788 -1.325 . . . . 20.0 109.788 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.88 165.26 48.64 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.142 0.877 . . . . 20.0 113.645 -174.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -86.54 168.23 13.88 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.56 1.144 . . . . 20.0 111.541 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 69.7 m -112.55 107.83 16.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.29 1.036 . . . . 20.0 110.27 175.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -129.09 159.14 70.39 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.953 2.101 . . . . 20.0 109.411 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.48 170.86 15.26 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.088 2.525 . . . . 20.0 113.07 -171.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.2 mt -54.14 -35.9 62.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.727 1.211 . . . . 20.0 112.479 169.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -79.84 4.89 15.16 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.81 1.644 . . . . 20.0 113.665 -175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -64.3 -13.23 48.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.186 1.394 . . . . 20.0 113.573 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? 72.29 2.69 4.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.048 2.139 . . . . 20.0 112.976 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 165.92 3.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.313 1.845 . . . . 20.0 111.064 167.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -139.44 92.1 2.55 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 123.922 0.889 . . . . 20.0 110.682 -172.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.423 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.1 tp10 -154.88 -173.49 4.59 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.39 1.476 . . . . 20.0 110.058 174.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.423 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.0 pp -55.98 152.58 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.184 1.394 . . . . 20.0 113.02 175.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -131.64 2.46 4.11 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.641 1.176 . . . . 20.0 112.381 -171.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.09 -78.33 0.18 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.139 1.376 . . . . 20.0 110.916 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -68.77 -33.11 73.34 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.885 1.274 . . . . 20.0 112.437 -175.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.1 m -62.16 -31.16 71.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.116 1.366 . . . . 20.0 112.251 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.5 -9.74 37.64 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 114.866 1.432 . . . . 20.0 114.866 -172.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.9 t -58.34 -16.7 15.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.682 1.593 . . . . 20.0 114.181 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -17.55 53.24 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.19 1.182 . . . . 20.0 114.19 -176.349 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 138.71 -81.02 0.27 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.027 0.822 . . . . 20.0 112.755 171.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.48 59.82 3.05 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.051 1.74 . . . . 20.0 111.965 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 48.93 23.95 4.0 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 129.863 3.601 . . . . 20.0 114.931 -176.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -41.69 146.02 0.27 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 128.213 2.605 . . . . 20.0 112.715 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -135.46 133.38 38.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.552 -1.204 . . . . 20.0 109.704 -177.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.45 131.93 29.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 124.314 1.009 . . . . 20.0 110.961 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.9 t -138.9 20.93 2.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.993 1.317 . . . . 20.0 111.525 -171.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 95.3 t -60.53 140.44 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 125.044 1.338 . . . . 20.0 109.776 170.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -125.36 176.05 7.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.896 1.679 . . . . 20.0 110.245 175.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.08 162.41 26.7 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.334 0.653 . . . . 20.0 110.794 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 117.328 -1.32 . . . . 20.0 110.478 175.113 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 . . . . . 0 N--CA 1.474 0.754 0 CA-C-O 121.173 0.511 . . . . 20.0 110.844 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -64.99 -41.34 95.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.15 0.98 . . . . 20.0 112.999 -170.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.7 m -58.05 -52.48 65.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.033 0.933 . . . . 20.0 110.902 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.38 -36.23 77.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.956 1.702 . . . . 20.0 111.414 -176.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 t -64.84 -35.97 82.83 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.674 1.189 . . . . 20.0 111.99 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -77.78 -18.13 56.76 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.543 0.737 . . . . 20.0 111.895 174.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.19 -7.67 35.21 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 126.598 2.047 . . . . 20.0 113.144 177.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -70.4 174.74 5.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.94 1.696 . . . . 20.0 112.279 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.71 -176.5 14.46 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.996 1.284 . . . . 20.0 112.604 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.1 m -125.74 58.55 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.414 1.485 . . . . 20.0 110.758 -173.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.83 156.42 87.11 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 125.035 1.334 . . . . 20.0 110.015 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -70.9 162.73 41.63 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.595 2.197 . . . . 20.0 110.875 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -65.6 -16.62 63.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.572 0.749 . . . . 20.0 111.962 173.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.9 m -72.84 -28.61 62.64 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.506 1.522 . . . . 20.0 113.067 173.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -107.59 -47.87 3.54 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.533 1.133 . . . . 20.0 111.24 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.2 t -65.94 121.04 73.96 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.909 1.284 . . . . 20.0 109.776 172.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.81 170.18 18.45 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.54 2.827 . . . . 20.0 110.499 174.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -77.94 -10.73 59.73 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.658 0.985 . . . . 20.0 113.658 -171.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -85.34 -37.46 19.89 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.89 2.076 . . . . 20.0 112.316 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 -2.85 43.12 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.35 1.86 . . . . 20.0 113.657 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.94 97.97 4.12 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 124.571 1.148 . . . . 20.0 110.997 -174.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.89 168.34 13.78 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.967 1.707 . . . . 20.0 111.402 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -85.45 -15.26 43.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.626 1.17 . . . . 20.0 112.971 -177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -66.37 167.67 10.14 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.431 1.492 . . . . 20.0 112.056 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.49 178.44 19.98 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.873 1.225 . . . . 20.0 112.265 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.88 -11.73 29.65 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 125.47 1.509 . . . . 20.0 113.02 -176.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.3 m -67.16 176.33 2.23 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.367 1.467 . . . . 20.0 112.537 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.7 t -101.14 -12.43 18.79 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.722 1.209 . . . . 20.0 111.736 174.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -139.64 -74.04 0.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.939 1.696 . . . . 20.0 109.807 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -163.89 143.42 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 125.047 1.339 . . . . 20.0 109.802 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.7 t -74.26 139.52 44.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.137 0.975 . . . . 20.0 109.704 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -138.3 124.81 20.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.641 0.776 . . . . 20.0 110.712 -175.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -73.09 82.06 1.27 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.046 0.939 . . . . 20.0 112.45 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.44 -31.67 72.89 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.747 1.219 . . . . 20.0 113.134 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -71.85 -11.98 61.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.572 1.149 . . . . 20.0 112.832 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -125.09 5.04 7.9 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.8 1.64 . . . . 20.0 112.957 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -46.02 14.86 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.996 1.718 . . . . 20.0 109.964 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -141.28 -47.47 0.39 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.741 1.616 . . . . 20.0 111.048 -176.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.85 -31.98 6.47 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 125.96 1.743 . . . . 20.0 113.138 -178.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 3.2 t -75.9 -22.13 56.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.446 1.123 . . . . 20.0 113.115 174.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 tttm 65.1 23.78 12.42 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 20.0 113.087 161.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -150.37 113.92 0.62 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 125.111 1.338 . . . . 20.0 110.751 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.1 ttpt 60.99 11.85 3.58 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 128.757 2.823 . . . . 20.0 114.916 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 -11.98 70.15 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 126.25 1.881 . . . . 20.0 112.865 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.5 108.66 0.07 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.212 1.863 . . . . 20.0 113.389 174.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.37 179.21 5.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.549 1.14 . . . . 20.0 111.021 168.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.4 t -137.55 57.34 1.74 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.166 0.986 . . . . 20.0 110.686 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.4 159.25 74.07 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.956 1.702 . . . . 20.0 112.08 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.07 164.12 31.32 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.524 2.816 . . . . 20.0 113.117 -176.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.27 -16.23 64.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.855 0.862 . . . . 20.0 112.607 172.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -65.87 -25.63 67.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.176 1.39 . . . . 20.0 112.763 172.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -68.96 148.62 49.88 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.923 0.889 . . . . 20.0 111.089 -175.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.33 9.1 24.45 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.286 1.034 . . . . 20.0 113.272 -178.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.4 t -60.24 169.23 1.69 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.166 1.386 . . . . 20.0 112.011 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -146.39 114.57 6.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.696 1.998 . . . . 20.0 108.354 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -152.96 176.18 12.14 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.291 0.567 . . . . 20.0 112.129 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.422 HD13 ' H ' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -58.05 140.45 52.49 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.839 1.656 . . . . 20.0 112.847 174.694 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -75.32 -9.9 58.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.363 1.865 . . . . 20.0 114.235 174.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.29 -71.91 0.28 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.968 0.907 . . . . 20.0 110.858 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.422 ' H ' HD13 ' A' ' 57' ' ' LEU . 3.8 mm-40 -65.97 -28.11 68.65 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.114 1.366 . . . . 20.0 113.056 -178.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -66.6 -41.51 88.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.351 0.5 . . . . 20.0 112.351 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.14 -19.74 63.2 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.733 0.813 . . . . 20.0 112.212 174.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.2 m -90.74 -17.27 26.98 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.386 1.474 . . . . 20.0 112.86 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.98 -45.27 74.63 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 125.058 1.343 . . . . 20.0 110.241 176.303 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 142.33 175.4 15.59 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.292 0.948 . . . . 20.0 113.035 170.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -79.54 73.89 6.21 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.918 1.287 . . . . 20.0 109.204 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 162.32 -18.1 0.16 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.042 1.306 . . . . 20.0 113.127 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -146.57 174.42 11.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.534 1.533 . . . . 20.0 112.288 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -157.06 162.94 39.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.011 1.724 . . . . 20.0 112.122 -171.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -69.05 153.06 44.41 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 118.213 0.461 . . . . 20.0 110.481 169.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.9 t -152.56 159.07 43.3 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.384 1.474 . . . . 20.0 109.886 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.4 t -145.92 160.15 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 127.104 2.161 . . . . 20.0 107.53 175.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 58.98 19.01 6.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.645 1.978 . . . . 20.0 114.508 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.71 119.08 8.59 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.32 1.848 . . . . 20.0 111.209 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 . . . . . 0 C--O 1.251 1.182 0 C-N-CA 124.321 1.049 . . . . 20.0 110.111 -177.636 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 109.289 -0.634 . . . . 20.0 109.289 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -67.75 -37.28 81.91 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.57 0.348 . . . . 20.0 111.318 -175.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.0 t -65.28 -41.4 94.21 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.337 1.455 . . . . 20.0 112.098 -177.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 73.4 t -77.0 -40.18 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 20.0 110.822 176.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.9 t -62.46 -36.27 81.93 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.781 1.232 . . . . 20.0 112.628 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -76.04 -6.43 51.03 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 20.0 113.341 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.37 25.4 21.42 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.799 -1.001 . . . . 20.0 113.977 171.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -111.13 174.62 5.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.542 1.137 . . . . 20.0 111.594 -177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.79 178.03 16.57 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.033 1.302 . . . . 20.0 113.063 -171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.9 m -123.51 69.33 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.242 1.417 . . . . 20.0 109.96 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mp -71.82 155.47 92.12 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 124.715 1.206 . . . . 20.0 109.29 171.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -72.01 162.01 43.1 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.162 2.575 . . . . 20.0 110.632 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -65.08 -24.38 67.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.209 0.604 . . . . 20.0 112.14 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -63.11 -39.43 94.68 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.689 1.196 . . . . 20.0 112.016 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -96.86 -47.8 5.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.412 1.085 . . . . 20.0 111.768 -176.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.13 118.12 36.42 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.36 1.464 . . . . 20.0 110.771 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -70.06 158.0 57.97 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.736 2.291 . . . . 20.0 110.355 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -77.84 -9.95 59.31 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.296 1.039 . . . . 20.0 112.708 -167.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.88 -37.71 39.5 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.306 2.242 . . . . 20.0 112.014 172.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.21 -5.05 55.46 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.413 1.485 . . . . 20.0 113.85 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -74.71 100.86 4.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.877 0.871 . . . . 20.0 111.523 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.6 mt -70.88 175.46 5.05 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.594 1.958 . . . . 20.0 112.605 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.4 p -99.75 -6.45 27.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.481 1.112 . . . . 20.0 113.56 177.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -72.34 172.83 9.64 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.328 1.051 . . . . 20.0 111.91 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.88 170.66 22.38 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.075 1.322 . . . . 20.0 111.684 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.54 12.41 3.39 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.176 1.369 . . . . 20.0 113.881 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 89.8 m -108.47 176.28 5.17 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 125.473 1.509 . . . . 20.0 111.856 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.1 m -110.31 -4.0 15.9 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.768 1.227 . . . . 20.0 111.912 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 p -137.16 -72.19 0.43 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.069 1.748 . . . . 20.0 109.634 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -160.12 143.24 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 124.681 1.193 . . . . 20.0 110.23 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.4 m -73.57 129.29 37.66 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 124.573 1.149 . . . . 20.0 110.245 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.3 t -131.11 113.55 14.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.434 1.094 . . . . 20.0 110.901 -174.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -63.52 108.24 1.32 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.992 2.117 . . . . 20.0 110.921 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.2 mt -83.04 -18.97 37.84 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.77 1.228 . . . . 20.0 113.272 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.5 p -78.75 -12.1 60.01 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.634 0.976 . . . . 20.0 113.634 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.28 5.11 23.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.053 1.741 . . . . 20.0 112.813 171.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.8 tp -107.94 -42.3 4.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.23 1.812 . . . . 20.0 110.765 -175.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.2 t -152.09 174.74 13.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.527 1.531 . . . . 20.0 111.435 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.19 170.35 27.14 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 125.869 1.699 . . . . 20.0 114.158 168.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.0 m -71.67 -54.64 9.69 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.762 1.225 . . . . 20.0 110.895 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.1 tptt 48.13 29.0 1.67 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.028 2.531 . . . . 20.0 115.447 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.9 -110.56 3.76 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 126.095 1.807 . . . . 20.0 110.198 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 tttm 65.32 6.75 3.81 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 128.95 2.9 . . . . 20.0 114.459 -178.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.33 1.9 47.62 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.293 1.901 . . . . 20.0 112.916 -171.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.29 169.76 39.5 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 125.708 1.623 . . . . 20.0 114.201 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -153.54 -179.4 7.74 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.077 1.14 . . . . 20.0 114.077 -169.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.0 m -113.1 82.26 1.63 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.917 2.087 . . . . 20.0 109.981 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.8 165.88 29.94 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 125.204 1.402 . . . . 20.0 111.438 173.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -67.66 150.98 79.73 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.833 3.022 . . . . 20.0 112.807 -176.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.8 mt -63.96 -19.25 65.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.81 1.244 . . . . 20.0 112.409 171.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.34 -24.2 65.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.564 1.545 . . . . 20.0 111.928 174.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -84.71 128.35 34.56 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.282 1.033 . . . . 20.0 110.243 175.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -67.87 107.45 2.64 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.715 1.606 . . . . 20.0 111.276 -175.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.1 t -156.93 -170.26 3.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.273 1.829 . . . . 20.0 109.727 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -120.15 174.81 6.26 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.473 1.909 . . . . 20.0 109.995 175.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -136.27 161.38 35.92 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.505 1.522 . . . . 20.0 111.742 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -137.18 22.47 3.01 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.994 1.718 . . . . 20.0 114.439 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . 0.254 23.1 pt20 53.92 21.45 2.83 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 130.366 3.466 . . . . 20.0 116.912 166.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.75 -87.1 0.64 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.568 1.547 . . . . 20.0 109.977 -170.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -75.45 -27.05 58.76 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.577 0.626 . . . . 20.0 110.928 174.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.6 p -71.42 11.93 0.4 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.73 2.012 . . . . 20.0 113.877 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.04 -9.81 8.68 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.909 1.684 . . . . 20.0 112.775 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 t -86.33 -46.85 9.9 Favored 'General case' 0 C--N 1.345 0.395 0 C-N-CA 124.399 1.08 . . . . 20.0 113.122 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 5.0 m -66.54 -8.7 28.48 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.596 1.559 . . . . 20.0 115.083 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.27 164.76 33.17 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.755 1.645 . . . . 20.0 112.778 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -48.34 117.7 2.09 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.273 1.429 . . . . 20.0 112.087 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.07 8.4 11.66 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-O 118.248 -1.307 . . . . 20.0 113.009 -171.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.5 pm0 -105.36 153.49 21.58 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.467 1.634 . . . . 20.0 112.622 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 166.52 33.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.955 2.102 . . . . 20.0 109.486 162.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.6 t -128.09 133.69 49.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.072 0.949 . . . . 20.0 111.045 -175.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 82.6 m -133.81 77.89 1.74 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.331 1.452 . . . . 20.0 109.638 -168.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 39.9 t -135.62 96.9 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.901 0.881 . . . . 20.0 108.81 -172.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.97 -179.68 4.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.969 1.708 . . . . 20.0 110.779 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -120.2 176.31 5.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.886 1.674 . . . . 20.0 112.003 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.7 t60 . . . . . 0 C--O 1.252 1.229 0 CA-C-O 116.728 -1.606 . . . . 20.0 111.825 -177.944 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 . . . . . 0 N--CA 1.478 0.935 0 CA-C-O 120.303 0.097 . . . . 20.0 110.869 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 -122.32 -44.06 2.28 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.453 1.101 . . . . 20.0 111.472 -175.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.34 -56.33 23.51 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.964 1.306 . . . . 20.0 111.205 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.1 t -72.36 -28.25 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 125.643 1.577 . . . . 20.0 111.006 -178.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.3 t -66.72 -38.31 86.45 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.308 1.043 . . . . 20.0 111.685 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -75.05 -10.54 59.57 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.566 1.146 . . . . 20.0 112.886 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.71 1.16 62.01 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.841 1.21 . . . . 20.0 114.817 172.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -73.01 175.26 6.82 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.423 1.112 . . . . 20.0 111.561 175.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -106.32 166.91 13.97 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 124.873 1.225 . . . . 20.0 112.226 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -118.71 69.17 0.8 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.245 1.418 . . . . 20.0 109.202 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.18 156.18 90.9 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.99 1.316 . . . . 20.0 109.69 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.48 161.77 44.6 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.658 2.239 . . . . 20.0 111.215 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -63.54 -24.61 67.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.031 0.932 . . . . 20.0 112.148 177.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 p -65.99 -46.56 77.55 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.836 1.254 . . . . 20.0 111.982 173.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -80.77 -52.58 7.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.553 1.141 . . . . 20.0 111.558 -176.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.4 t -67.94 120.35 73.35 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.903 1.281 . . . . 20.0 110.657 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -69.31 161.49 45.66 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.316 2.677 . . . . 20.0 110.845 175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.71 -21.08 62.6 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.008 1.323 . . . . 20.0 112.696 -166.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.22 -39.46 59.98 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.877 2.471 . . . . 20.0 112.113 176.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.08 -5.21 55.48 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.083 1.353 . . . . 20.0 113.415 -177.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.98 102.39 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 124.291 1.036 . . . . 20.0 110.646 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.41 170.19 14.77 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.53 1.132 . . . . 20.0 111.983 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -91.91 -9.69 42.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.286 1.434 . . . . 20.0 112.698 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -71.41 159.88 33.75 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.693 1.197 . . . . 20.0 112.358 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -112.8 -179.5 19.49 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.7 1.619 . . . . 20.0 112.802 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.43 -5.75 41.4 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.382 1.467 . . . . 20.0 114.071 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.5 m -82.44 178.32 8.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.925 1.29 . . . . 20.0 112.524 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -114.57 -2.35 13.15 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.539 1.536 . . . . 20.0 111.649 175.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.8 p -138.64 -74.25 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.225 1.81 . . . . 20.0 109.841 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -166.74 143.61 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 126.526 1.93 . . . . 20.0 108.967 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.05 145.08 40.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.48 0.712 . . . . 20.0 110.265 173.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.09 118.66 14.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.854 0.861 . . . . 20.0 110.304 -176.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 93.13 0.33 Allowed 'General case' 0 C--N 1.346 0.417 0 C-N-CA 123.793 0.837 . . . . 20.0 111.665 178.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.31 -28.22 67.81 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.494 0.717 . . . . 20.0 111.65 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 t -78.38 -11.74 59.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.496 1.518 . . . . 20.0 113.226 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -132.17 8.14 4.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.806 1.242 . . . . 20.0 113.465 -176.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.18 -36.2 79.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.208 1.803 . . . . 20.0 112.093 -176.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 80.7 p -118.02 -37.92 3.31 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.645 1.578 . . . . 20.0 112.305 -173.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.38 -161.96 50.13 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.294 0.949 . . . . 20.0 113.213 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.2 t -62.97 -66.46 0.54 Allowed 'General case' 0 C--N 1.342 0.243 0 C-N-CA 124.297 1.039 . . . . 20.0 109.88 169.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 tttm 55.79 15.3 1.59 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.563 2.345 . . . . 20.0 114.84 -176.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.61 -32.19 7.49 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 126.955 2.217 . . . . 20.0 112.388 -176.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm 62.04 9.65 3.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.328 3.051 . . . . 20.0 114.736 172.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 6.96 66.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.029 1.776 . . . . 20.0 113.712 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.43 -161.05 4.36 Favored Glycine 0 C--N 1.343 0.947 0 C-N-CA 126.618 2.056 . . . . 20.0 114.021 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -130.53 171.45 13.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 122.95 0.5 . . . . 20.0 112.272 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.2 t -98.57 107.58 20.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.96 0.904 . . . . 20.0 110.421 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -137.21 156.51 75.38 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.878 2.471 . . . . 20.0 109.518 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.69 164.69 30.29 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.593 2.862 . . . . 20.0 113.494 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.55 -21.14 64.01 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.682 1.593 . . . . 20.0 112.702 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -98.8 9.9 42.41 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.843 1.657 . . . . 20.0 113.337 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.4 tpt85 -74.78 33.13 0.09 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.442 1.897 . . . . 20.0 112.985 175.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.28 -8.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 129.568 3.147 . . . . 20.0 114.459 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 59.3 m -74.29 148.84 41.07 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.554 1.542 . . . . 20.0 111.274 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -150.26 116.25 5.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.352 1.461 . . . . 20.0 110.493 173.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.444 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 5.3 tp10 -160.26 -173.97 4.29 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.328 1.451 . . . . 20.0 109.97 178.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.444 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.0 pp -56.94 158.47 4.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.252 1.821 . . . . 20.0 113.061 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -121.17 -0.52 9.93 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.931 2.092 . . . . 20.0 113.692 174.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.92 -9.56 39.48 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.748 1.619 . . . . 20.0 114.623 176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -135.07 -42.66 0.73 Allowed 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.208 1.403 . . . . 20.0 111.44 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.2 p -63.43 -16.45 60.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.356 1.462 . . . . 20.0 113.907 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.81 -2.3 0.53 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.011 2.124 . . . . 20.0 114.009 171.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m -56.97 -39.73 75.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.2 1.8 . . . . 20.0 112.748 172.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.5 t -76.46 -15.76 59.83 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 119.058 0.845 . . . . 20.0 112.684 173.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.45 -175.54 21.88 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 126.099 1.809 . . . . 20.0 111.365 -171.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -65.47 99.86 0.45 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.567 1.547 . . . . 20.0 109.642 175.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.07 -24.85 0.61 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.182 1.372 . . . . 20.0 112.832 -175.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -105.08 138.51 41.17 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.993 1.397 . . . . 20.0 111.672 -175.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.48 138.64 46.25 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.838 2.455 . . . . 20.0 110.746 175.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.0 t -55.6 110.76 0.76 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.544 1.138 . . . . 20.0 111.428 -177.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.9 t -138.92 72.38 1.4 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 123.415 0.686 . . . . 20.0 112.348 -169.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 45.8 t -141.47 113.89 4.12 Favored 'Isoleucine or valine' 0 C--N 1.338 0.1 0 C-N-CA 124.749 1.22 . . . . 20.0 109.42 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -79.27 -8.46 59.06 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.711 1.604 . . . . 20.0 113.869 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.4 tp -82.38 160.12 22.86 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.896 2.078 . . . . 20.0 110.37 177.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.3 t60 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.314 2.245 . . . . 20.0 112.518 174.811 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 119.424 -0.322 . . . . 20.0 110.802 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 79.8 m -65.25 -26.2 68.0 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.631 1.173 . . . . 20.0 112.996 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.1 t -65.02 -52.77 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.057 1.343 . . . . 20.0 109.905 167.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 t -63.28 -30.84 71.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.866 1.266 . . . . 20.0 112.94 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.66 -31.22 21.19 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.782 1.233 . . . . 20.0 111.942 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.25 58.88 1.19 Allowed Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.202 1.382 . . . . 20.0 113.324 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -127.44 -178.76 4.58 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.001 2.12 . . . . 20.0 111.25 174.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.91 178.83 32.4 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.27 1.414 . . . . 20.0 113.037 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.5 m -128.37 30.3 5.2 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.545 1.938 . . . . 20.0 112.239 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.6 148.11 67.67 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.111 0.965 . . . . 20.0 110.825 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.93 164.08 36.8 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.136 2.557 . . . . 20.0 111.841 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -60.07 -29.6 68.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.059 1.743 . . . . 20.0 112.221 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.0 m -72.71 -35.19 67.53 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.179 0.992 . . . . 20.0 112.602 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -81.21 -65.65 0.99 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.14 0.976 . . . . 20.0 110.405 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 m -70.51 154.3 94.5 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 123.697 0.799 . . . . 20.0 111.359 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.24 173.39 14.59 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.694 2.929 . . . . 20.0 111.719 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.42 -18.56 61.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.065 1.346 . . . . 20.0 113.037 -174.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -90.7 -36.54 14.27 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.958 2.103 . . . . 20.0 112.877 -175.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.45 -9.74 57.27 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.505 1.522 . . . . 20.0 113.658 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.12 101.46 1.44 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.661 1.585 . . . . 20.0 110.702 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -72.22 164.02 26.96 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.672 1.189 . . . . 20.0 111.106 175.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.9 m -94.39 -11.35 30.08 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.084 1.353 . . . . 20.0 113.172 -175.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.436 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 24.1 m-85 -64.88 168.58 6.15 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.67 1.988 . . . . 20.0 112.278 177.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -123.89 -178.6 15.46 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.889 1.233 . . . . 20.0 113.935 -175.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.93 -16.47 54.3 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.833 2.159 . . . . 20.0 114.444 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.1 m -73.07 -178.63 2.92 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.778 1.231 . . . . 20.0 112.65 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -94.7 -18.0 21.71 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.676 0.79 . . . . 20.0 111.958 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 p -142.1 -73.02 0.31 Allowed 'General case' 0 C--N 1.34 0.177 0 C-N-CA 125.455 1.502 . . . . 20.0 109.454 -173.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.51 148.64 11.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.574 1.549 . . . . 20.0 108.208 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.9 m -84.62 145.68 27.89 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.735 0.414 . . . . 20.0 110.217 173.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 45.2 t -134.49 120.87 20.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.557 1.143 . . . . 20.0 110.124 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.34 88.43 0.64 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.69 1.196 . . . . 20.0 112.747 -178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.5 mt -66.1 -22.14 66.39 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.555 1.142 . . . . 20.0 112.571 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.1 m -65.68 -22.08 66.6 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 125.812 1.645 . . . . 20.0 112.6 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.8 mttm . . . . . 0 CA--C 1.533 0.324 0 C-N-CA 125.595 1.558 . . . . 20.0 112.569 -170.026 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm . . . . . 0 CA--C 1.535 0.368 0 CA-C-O 118.589 -0.72 . . . . 20.0 112.692 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 141.77 -38.71 1.47 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 124.338 0.971 . . . . 20.0 112.365 167.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 170.64 46.66 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.333 0.968 . . . . 20.0 113.797 171.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -153.59 129.09 9.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.925 1.29 . . . . 20.0 110.369 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.6 m -87.99 128.75 35.39 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.362 1.065 . . . . 20.0 109.121 162.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.35 159.15 73.0 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 126.016 1.727 . . . . 20.0 109.124 168.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.15 160.3 38.94 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.841 3.027 . . . . 20.0 112.723 -170.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.32 -20.64 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.243 1.017 . . . . 20.0 112.362 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -28.29 65.52 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.917 1.687 . . . . 20.0 111.772 175.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.9 ttm-85 -99.45 111.64 23.96 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.448 1.099 . . . . 20.0 110.04 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -73.98 116.31 14.46 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.331 1.453 . . . . 20.0 109.346 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 45.8 t -144.59 -91.54 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.666 1.187 . . . . 20.0 110.276 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.431 ' HE3' ' HA ' ' A' ' 71' ' ' CYS . 22.2 ttpp -154.06 158.24 40.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.229 1.812 . . . . 20.0 109.646 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -131.68 133.08 44.49 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.841 1.256 . . . . 20.0 110.278 -176.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 tp -159.18 103.59 1.65 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.013 1.325 . . . . 20.0 110.144 -171.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -66.27 -6.69 14.73 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.96 1.704 . . . . 20.0 115.061 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.95 78.99 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.324 1.05 . . . . 20.0 113.473 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -137.24 -49.42 0.61 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.282 1.033 . . . . 20.0 111.337 -169.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.5 p -67.82 -10.23 51.12 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.106 1.151 . . . . 20.0 114.106 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.44 -20.57 46.04 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.617 1.339 . . . . 20.0 114.617 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 90.7 p -125.13 34.59 4.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.836 1.254 . . . . 20.0 112.135 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.4 -13.8 59.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.633 0.975 . . . . 20.0 113.633 174.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.15 -103.23 0.89 Allowed Glycine 0 C--N 1.343 0.958 0 C-N-CA 125.349 1.452 . . . . 20.0 110.573 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -70.31 93.72 0.88 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.244 1.417 . . . . 20.0 109.474 173.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.88 60.18 1.09 Allowed Glycine 0 C--N 1.337 0.617 0 C-N-CA 124.502 1.049 . . . . 20.0 112.614 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -75.1 36.4 0.11 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.935 2.494 . . . . 20.0 114.858 177.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -119.75 99.46 6.66 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.664 1.986 . . . . 20.0 111.703 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.31 125.75 28.53 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.443 1.497 . . . . 20.0 110.962 173.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.431 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 80.5 m -127.5 135.66 50.68 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.828 1.651 . . . . 20.0 109.867 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 CA--C 1.536 0.405 0 C-N-CA 124.886 1.274 . . . . 20.0 108.993 175.636 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 112.58 0.585 . . . . 20.0 112.58 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.0 m -53.58 -59.86 4.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.9 1.68 . . . . 20.0 110.946 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.8 t -64.3 -34.26 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 125.699 1.6 . . . . 20.0 111.387 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -68.78 -16.96 63.95 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.901 1.28 . . . . 20.0 112.925 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -102.29 -7.71 21.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.121 1.768 . . . . 20.0 112.139 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.7 0.08 52.61 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.335 1.922 . . . . 20.0 114.133 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -86.32 177.09 7.58 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.042 1.737 . . . . 20.0 111.131 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.97 -176.54 16.42 Favored Glycine 0 C--N 1.341 0.81 0 C-N-CA 124.851 1.215 . . . . 20.0 113.229 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.31 76.57 1.73 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.795 1.638 . . . . 20.0 109.304 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.09 162.02 75.81 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 125.103 1.361 . . . . 20.0 109.627 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.23 161.76 44.82 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.48 2.12 . . . . 20.0 110.457 170.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.73 -26.92 68.93 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.964 0.906 . . . . 20.0 111.469 171.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.4 m -69.73 -16.31 63.3 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.045 1.338 . . . . 20.0 113.582 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -122.34 -41.83 2.39 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.828 1.251 . . . . 20.0 111.825 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.6 t -67.63 119.46 66.11 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 123.878 0.871 . . . . 20.0 109.883 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.91 163.14 38.66 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.175 2.583 . . . . 20.0 111.276 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -72.32 -3.56 24.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.788 1.635 . . . . 20.0 113.268 -170.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -100.27 -36.51 9.25 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.248 2.619 . . . . 20.0 111.846 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.51 -13.6 59.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.167 1.387 . . . . 20.0 113.589 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -67.02 120.87 14.37 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.888 1.275 . . . . 20.0 110.852 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.4 mt -86.81 178.83 6.88 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.855 1.262 . . . . 20.0 110.829 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -102.22 -1.31 31.53 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.242 1.417 . . . . 20.0 112.688 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -68.02 174.9 3.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.968 1.707 . . . . 20.0 113.398 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.24 -176.77 14.57 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.92 1.724 . . . . 20.0 112.812 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.89 -11.79 59.08 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 126.148 1.832 . . . . 20.0 113.422 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 71.2 m -74.0 175.86 7.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.504 1.152 . . . . 20.0 112.78 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.7 m -106.27 -14.72 15.04 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.917 1.287 . . . . 20.0 111.938 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.2 p -138.01 -69.71 0.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.046 1.738 . . . . 20.0 109.985 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -157.12 156.11 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 125.35 1.46 . . . . 20.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -79.47 161.46 26.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.979 0.912 . . . . 20.0 110.338 171.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -151.35 117.56 5.61 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.638 0.775 . . . . 20.0 110.793 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -70.75 98.77 1.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.643 1.577 . . . . 20.0 110.405 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.3 mt -79.59 -16.46 55.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.402 1.081 . . . . 20.0 113.19 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -71.11 -33.19 69.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.37 1.068 . . . . 20.0 111.455 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 125.117 1.367 . . . . 20.0 112.959 177.691 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 112.576 0.584 . . . . 20.0 112.576 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 166.77 -35.2 0.23 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.617 1.103 . . . . 20.0 112.944 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.13 166.84 15.09 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 125.248 1.404 . . . . 20.0 113.99 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -151.03 167.49 27.5 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.767 1.227 . . . . 20.0 112.68 -172.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.8 m -87.23 66.14 9.1 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.421 1.488 . . . . 20.0 110.848 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.75 158.45 87.77 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.252 1.021 . . . . 20.0 111.177 172.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.86 156.22 66.78 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 124.066 3.177 . . . . 20.0 112.092 -173.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.16 -20.63 65.58 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 20.0 113.083 173.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.47 -15.16 62.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.714 1.606 . . . . 20.0 112.872 175.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.405 HH11 ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -80.9 139.8 35.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 20.0 110.201 178.361 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -80.5 101.83 9.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.796 -0.816 . . . . 20.0 108.796 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.416 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -156.9 175.49 14.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.07 1.348 . . . . 20.0 109.995 179.55 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -76.91 159.12 30.26 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.697 0.799 . . . . 20.0 109.715 170.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -125.18 144.15 50.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.603 1.161 . . . . 20.0 110.117 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.6 170.71 14.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.403 2.281 . . . . 20.0 110.19 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -104.02 -4.07 23.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.059 1.744 . . . . 20.0 110.812 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.37 -82.46 0.08 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.101 1.76 . . . . 20.0 111.564 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.2 -32.68 61.28 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.135 1.374 . . . . 20.0 112.542 -173.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.94 -25.04 67.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.511 1.124 . . . . 20.0 111.934 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.51 -19.82 63.72 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.355 1.062 . . . . 20.0 113.663 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.8 m -66.53 -56.19 11.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.992 1.317 . . . . 20.0 110.269 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 83.1 m -70.83 -21.79 62.4 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.859 0.864 . . . . 20.0 112.01 173.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.47 -94.06 1.67 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.945 2.212 . . . . 20.0 112.736 172.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -138.48 164.04 30.4 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.782 1.633 . . . . 20.0 111.754 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.57 -16.82 59.93 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.926 1.251 . . . . 20.0 112.783 -170.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -122.08 178.5 4.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.988 1.715 . . . . 20.0 112.417 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -150.32 156.21 41.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.579 2.751 . . . . 20.0 108.697 169.017 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 37.4 t -73.97 133.04 42.98 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.597 -0.52 . . . . 20.0 109.597 172.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.6 t -156.06 163.32 39.82 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.666 1.187 . . . . 20.0 110.351 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 124.906 1.283 . . . . 20.0 110.588 176.526 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 112.036 0.384 . . . . 20.0 112.036 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.75 -36.7 83.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.079 0.952 . . . . 20.0 111.983 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.3 t -68.44 -43.3 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.894 1.278 . . . . 20.0 110.513 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.0 m -62.57 -42.82 99.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.175 0.99 . . . . 20.0 111.967 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -66.13 -22.08 66.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.775 1.23 . . . . 20.0 112.663 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.0 3.34 55.87 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.513 1.53 . . . . 20.0 114.597 176.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.91 -179.53 3.23 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.425 1.49 . . . . 20.0 111.684 174.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.6 171.91 13.98 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.955 1.264 . . . . 20.0 113.382 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.08 63.38 0.79 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.715 1.606 . . . . 20.0 110.071 176.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.03 156.21 92.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 124.522 1.129 . . . . 20.0 109.874 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.21 160.67 48.75 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.663 2.242 . . . . 20.0 110.6 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -63.59 -23.15 67.27 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.078 0.951 . . . . 20.0 111.385 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.3 t -59.87 -57.02 14.67 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.016 1.327 . . . . 20.0 111.039 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -85.58 -45.64 11.56 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.589 0.756 . . . . 20.0 111.436 -169.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -65.07 124.27 86.3 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.165 0.986 . . . . 20.0 110.416 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -69.09 161.58 45.26 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.915 2.41 . . . . 20.0 110.776 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -77.75 -0.46 27.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.934 1.294 . . . . 20.0 113.65 -169.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -102.79 -35.23 8.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.25 2.22 . . . . 20.0 112.521 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.95 -12.77 61.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.477 1.111 . . . . 20.0 113.638 175.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -66.99 121.21 15.05 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 124.773 1.229 . . . . 20.0 110.508 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.3 mt -84.26 169.74 14.41 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.803 1.241 . . . . 20.0 112.569 -176.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.6 p -84.36 -16.54 42.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 20.0 112.627 175.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -73.91 172.58 11.33 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.703 2.001 . . . . 20.0 111.809 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.78 -179.15 15.95 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.734 1.635 . . . . 20.0 111.775 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.23 25.18 1.69 Allowed Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.378 0.99 . . . . 20.0 113.845 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.6 m -128.29 -179.77 5.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.671 1.588 . . . . 20.0 111.8 -173.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.6 m -104.5 -11.78 16.84 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.749 0.819 . . . . 20.0 112.215 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.3 p -138.4 -66.81 0.48 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.922 1.289 . . . . 20.0 109.807 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.0 155.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.251 1.82 . . . . 20.0 108.934 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.8 m -82.65 160.1 22.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.035 0.534 . . . . 20.0 110.701 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 t -147.16 119.08 8.13 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.368 0.667 . . . . 20.0 110.051 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -69.75 99.32 1.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.237 1.415 . . . . 20.0 110.262 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 mt -77.23 -13.55 59.92 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.249 1.02 . . . . 20.0 112.663 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.7 t -85.02 -16.11 41.87 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.647 1.579 . . . . 20.0 113.218 -177.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.4 pttp . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 124.88 1.272 . . . . 20.0 113.212 175.001 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 113.218 0.821 . . . . 20.0 113.218 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.54 35.39 0.65 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.196 1.379 . . . . 20.0 111.912 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.16 157.47 27.68 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.139 1.352 . . . . 20.0 113.637 -173.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -146.32 155.84 42.92 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.894 1.278 . . . . 20.0 109.822 -175.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 18.8 t -106.55 111.91 24.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.794 1.638 . . . . 20.0 109.135 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -141.48 156.33 66.91 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 127.305 2.242 . . . . 20.0 110.291 -167.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.23 161.25 34.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.226 2.617 . . . . 20.0 113.497 -170.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.07 -18.43 65.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.808 0.843 . . . . 20.0 112.238 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -66.85 -22.39 65.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.066 1.747 . . . . 20.0 112.041 172.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.38 122.95 26.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.56 1.544 . . . . 20.0 109.138 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -69.93 104.06 2.41 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.587 1.155 . . . . 20.0 110.574 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 t -159.82 175.75 12.73 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.388 1.475 . . . . 20.0 110.296 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -78.38 141.38 38.41 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.672 1.189 . . . . 20.0 109.372 171.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.84 133.24 49.16 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.121 1.368 . . . . 20.0 109.172 173.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.22 122.16 23.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.393 1.877 . . . . 20.0 111.041 -170.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -64.43 -15.96 61.55 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.748 1.619 . . . . 20.0 114.129 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.47 63.91 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.268 1.427 . . . . 20.0 113.793 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -139.17 -37.68 0.51 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.672 1.189 . . . . 20.0 112.518 -168.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.8 t -64.42 -29.39 70.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.5 1.12 . . . . 20.0 112.447 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.62 72.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.581 0.752 . . . . 20.0 111.711 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.0 m -79.58 -33.14 41.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.045 1.338 . . . . 20.0 111.972 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.7 m -63.87 -34.02 77.01 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.388 1.075 . . . . 20.0 111.47 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.68 170.84 47.25 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 125.728 1.632 . . . . 20.0 112.796 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 126.24 26.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.648 1.179 . . . . 20.0 111.627 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 114.23 -19.68 17.19 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.689 1.614 . . . . 20.0 113.298 -178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -138.44 177.32 7.97 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.222 1.809 . . . . 20.0 111.98 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -151.31 173.37 14.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.827 2.051 . . . . 20.0 111.492 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.0 t -91.5 147.17 23.21 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.067 0.547 . . . . 20.0 109.779 163.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 49.9 t -144.0 161.17 39.45 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.758 1.223 . . . . 20.0 109.936 172.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.2 t . . . . . 0 CA--C 1.537 0.464 0 C-N-CA 126.251 1.821 . . . . 20.0 109.033 -179.309 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 CA--C 1.532 0.287 0 N-CA-C 112.035 0.383 . . . . 20.0 112.035 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.32 -36.27 81.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.373 1.069 . . . . 20.0 111.97 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 63.0 t -76.71 -41.99 33.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.49 1.516 . . . . 20.0 110.776 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 t -61.59 -44.16 97.53 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.182 1.393 . . . . 20.0 111.976 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -68.25 -12.97 61.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.469 1.508 . . . . 20.0 113.164 176.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.43 1.28 56.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.145 1.355 . . . . 20.0 114.603 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -74.71 175.17 8.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.57 1.185 . . . . 20.0 112.09 -178.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -103.6 175.9 23.77 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.014 1.292 . . . . 20.0 112.399 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -132.77 65.77 1.58 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.599 1.559 . . . . 20.0 109.42 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.94 158.12 87.65 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.135 0.974 . . . . 20.0 110.028 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.34 165.49 30.32 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.183 2.589 . . . . 20.0 111.389 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -60.92 -32.47 71.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.205 0.602 . . . . 20.0 111.374 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -65.66 -45.69 82.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.096 0.958 . . . . 20.0 112.162 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.61 -49.85 10.73 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.024 0.93 . . . . 20.0 111.725 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -67.64 124.94 90.52 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.193 0.997 . . . . 20.0 110.574 -179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.74 160.78 48.17 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.802 2.335 . . . . 20.0 110.25 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -73.09 -18.49 61.3 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.732 0.813 . . . . 20.0 112.735 -170.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.4 -41.17 33.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.98 2.112 . . . . 20.0 112.365 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -9.02 58.2 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.69 1.196 . . . . 20.0 113.488 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -70.5 113.7 7.88 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.518 1.127 . . . . 20.0 110.748 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 37.4 mt -84.88 170.74 12.82 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.187 1.395 . . . . 20.0 111.957 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 98.0 p -82.44 -13.64 56.43 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.337 1.055 . . . . 20.0 113.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -74.76 175.25 8.14 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.804 1.241 . . . . 20.0 112.591 -175.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -137.14 -176.93 14.66 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.35 1.452 . . . . 20.0 112.317 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.46 -4.73 33.04 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.508 1.528 . . . . 20.0 113.332 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.8 m -78.9 176.33 9.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.663 1.185 . . . . 20.0 111.984 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.8 t -111.54 -6.86 14.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.238 1.415 . . . . 20.0 111.579 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.6 p -131.6 -75.42 0.52 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.165 1.786 . . . . 20.0 109.021 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.2 p -165.58 151.89 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 126.852 2.061 . . . . 20.0 108.358 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.6 m -67.8 154.71 40.95 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.388 0.675 . . . . 20.0 111.497 172.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.3 t -151.06 113.69 4.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.589 0.755 . . . . 20.0 110.132 174.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -69.57 102.72 1.9 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.96 0.904 . . . . 20.0 110.165 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 mt -68.7 -22.28 64.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.189 0.996 . . . . 20.0 111.941 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 t -82.9 -7.0 59.7 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.823 1.649 . . . . 20.0 112.884 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt . . . . . 0 N--CA 1.472 0.658 0 C-N-CA 125.243 1.417 . . . . 20.0 112.803 179.116 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.6 mmtm . . . . . 0 N--CA 1.466 0.358 0 N-CA-C 113.434 0.901 . . . . 20.0 113.434 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.34 31.94 2.48 Favored Glycine 0 CA--C 1.532 1.138 0 CA-C-O 118.847 -0.974 . . . . 20.0 112.538 -170.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.67 179.41 20.17 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.714 1.626 . . . . 20.0 112.21 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -119.88 166.57 13.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.163 1.385 . . . . 20.0 112.323 -171.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 49.2 m -90.84 -43.14 10.23 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.268 1.027 . . . . 20.0 113.758 -173.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.68 171.03 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.217 2.207 . . . . 20.0 114.537 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.85 149.58 66.48 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.261 1.974 . . . . 20.0 110.713 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.58 -24.23 65.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.001 1.32 . . . . 20.0 113.076 177.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -78.11 -8.44 58.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.978 1.711 . . . . 20.0 113.076 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 164.73 26.0 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.587 1.155 . . . . 20.0 110.374 170.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -107.56 104.15 13.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.533 1.533 . . . . 20.0 109.265 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -158.78 167.67 28.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.957 1.703 . . . . 20.0 110.602 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.55 160.45 31.46 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.889 1.275 . . . . 20.0 111.818 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -133.22 114.26 13.61 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 126.247 1.819 . . . . 20.0 109.494 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pp -136.29 103.38 5.28 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.955 1.702 . . . . 20.0 110.235 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -61.26 -12.16 12.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.635 1.974 . . . . 20.0 113.564 -173.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.67 95.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.796 1.638 . . . . 20.0 113.325 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -119.74 -40.39 2.76 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.897 1.279 . . . . 20.0 111.429 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.3 p -70.52 -15.22 62.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.544 1.138 . . . . 20.0 113.911 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.8 18.65 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.534 1.309 . . . . 20.0 114.534 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 59.7 p -112.73 17.86 18.74 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.894 1.678 . . . . 20.0 113.572 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.8 m -67.27 -83.41 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.66 1.184 . . . . 20.0 111.286 174.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.2 -28.84 9.29 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.143 1.354 . . . . 20.0 114.399 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -136.11 35.84 2.8 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.303 1.441 . . . . 20.0 112.805 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -166.69 -45.86 0.02 OUTLIER Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.159 -0.801 . . . . 20.0 113.59 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.55 25.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 129.003 2.921 . . . . 20.0 117.017 -172.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.07 129.42 46.61 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 126.949 2.1 . . . . 20.0 108.749 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.2 t -110.38 127.92 55.32 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.989 0.916 . . . . 20.0 109.279 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.7 t -129.59 120.85 25.97 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.113 1.365 . . . . 20.0 108.855 -174.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 124.974 1.309 . . . . 20.0 108.092 -171.8 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 119.289 -0.386 . . . . 20.0 111.768 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 33.2 m -63.91 -39.1 93.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.915 -0.565 . . . . 20.0 111.431 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.0 t -66.89 -35.4 74.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.192 0.997 . . . . 20.0 111.132 174.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -65.61 -35.46 80.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.139 0.976 . . . . 20.0 112.106 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.55 -28.06 41.25 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.592 1.157 . . . . 20.0 112.326 176.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.75 -1.32 32.06 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.408 1.48 . . . . 20.0 114.126 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -70.22 176.67 3.73 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.387 1.475 . . . . 20.0 111.588 172.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.96 179.13 20.5 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 125.263 1.411 . . . . 20.0 113.234 -175.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.9 m -132.56 54.43 1.95 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.153 1.781 . . . . 20.0 110.423 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.57 159.92 64.12 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.367 1.467 . . . . 20.0 111.276 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -68.92 158.31 58.42 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.463 2.109 . . . . 20.0 110.931 171.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.13 -24.65 67.77 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.451 1.1 . . . . 20.0 111.589 176.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.7 m -72.62 -19.53 61.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.222 1.409 . . . . 20.0 113.458 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -107.12 -54.34 2.49 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.758 1.223 . . . . 20.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.92 120.55 67.55 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.603 1.161 . . . . 20.0 110.259 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -68.46 165.55 28.68 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.977 2.451 . . . . 20.0 110.735 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -71.16 -14.62 62.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.904 0.882 . . . . 20.0 113.129 -170.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -85.18 -40.7 16.4 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.499 2.32 . . . . 20.0 112.432 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.06 -7.16 52.92 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.634 1.574 . . . . 20.0 113.613 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.57 107.68 5.21 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.458 1.503 . . . . 20.0 110.961 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -72.57 168.32 18.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.004 1.322 . . . . 20.0 112.139 177.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -89.48 -13.94 36.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.43 1.492 . . . . 20.0 112.75 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.43 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 27.6 m-85 -66.25 172.31 4.01 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.103 2.161 . . . . 20.0 111.992 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -138.97 -175.83 14.25 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.683 1.135 . . . . 20.0 113.18 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.4 -11.29 56.74 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.115 1.817 . . . . 20.0 113.632 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.3 m -69.7 175.09 4.45 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.58 1.152 . . . . 20.0 112.782 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.5 p -100.06 -14.52 18.58 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.656 1.583 . . . . 20.0 111.84 -176.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 p -141.6 -72.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.917 2.087 . . . . 20.0 109.156 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -159.05 154.02 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.481 1.512 . . . . 20.0 108.703 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 67.9 m -72.45 161.15 31.19 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.883 0.473 . . . . 20.0 111.711 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.3 120.86 6.92 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.163 0.985 . . . . 20.0 109.988 171.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -70.24 92.84 0.8 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 20.0 111.827 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.8 -37.07 86.38 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.496 1.119 . . . . 20.0 112.182 -174.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.1 t -63.04 -31.61 72.79 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.494 1.118 . . . . 20.0 111.95 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp . . . . . 0 CA--C 1.534 0.363 0 C-N-CA 124.429 1.091 . . . . 20.0 113.396 -176.897 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mptt . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 119.218 -0.42 . . . . 20.0 112.008 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 86.0 -26.25 6.24 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.475 1.988 . . . . 20.0 112.907 -172.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.17 -171.3 48.83 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.175 1.369 . . . . 20.0 114.066 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.3 176.58 7.83 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.447 1.499 . . . . 20.0 112.002 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.0 t -108.46 101.48 10.65 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.007 1.323 . . . . 20.0 110.15 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -130.32 154.64 81.52 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 128.352 2.661 . . . . 20.0 110.945 -170.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.83 162.1 41.08 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.159 2.572 . . . . 20.0 113.221 -170.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.416 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 83.8 mt -66.39 -20.9 66.19 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.138 0.575 . . . . 20.0 112.142 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -69.37 -20.06 63.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.814 1.646 . . . . 20.0 112.391 174.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -68.46 144.59 54.61 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.371 1.068 . . . . 20.0 109.286 171.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -90.1 100.82 13.57 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.306 0.642 . . . . 20.0 109.797 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.39 176.73 9.54 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.737 1.615 . . . . 20.0 111.014 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -117.44 109.94 17.38 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.038 1.335 . . . . 20.0 111.138 -171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HA ' ' H ' ' A' ' 70' ' ' CYS . 1.8 pm0 -64.84 173.31 2.34 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.271 2.229 . . . . 20.0 114.507 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.1 mt -147.41 129.87 15.83 Favored 'General case' 0 C--N 1.347 0.462 0 C-N-CA 126.578 1.951 . . . . 20.0 109.847 167.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -64.29 -12.49 42.09 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.505 0.928 . . . . 20.0 113.505 166.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.86 -70.86 0.43 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.408 1.483 . . . . 20.0 110.969 167.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -85.31 -49.63 8.01 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.07 0.948 . . . . 20.0 112.865 -166.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 p -70.17 -7.01 38.41 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.615 1.166 . . . . 20.0 113.398 -174.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.79 -14.3 62.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.31 1.444 . . . . 20.0 113.663 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.9 t -64.8 -54.83 24.95 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.843 1.257 . . . . 20.0 112.584 -175.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.7 m -74.37 -15.44 60.93 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 118.709 -0.663 . . . . 20.0 112.322 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.39 -154.73 35.08 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-N 119.382 0.992 . . . . 20.0 112.925 175.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -60.19 110.34 1.2 Allowed 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.224 1.41 . . . . 20.0 110.602 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 124.59 -0.1 8.59 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.517 1.532 . . . . 20.0 113.325 -175.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -119.96 149.1 42.67 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.567 1.547 . . . . 20.0 111.596 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 17.2 ptpt -141.34 151.23 43.39 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.779 2.031 . . . . 20.0 109.461 165.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.471 ' H ' ' HA ' ' A' ' 56' ' ' GLU . 8.5 t -63.67 132.28 50.61 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.369 -0.604 . . . . 20.0 109.369 172.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.3 t -157.17 115.09 3.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.778 0.831 . . . . 20.0 110.37 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.617 1.167 . . . . 20.0 111.029 170.421 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 . . . . . 0 N--CA 1.465 0.294 0 CA-C-O 119.239 -0.41 . . . . 20.0 110.827 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 39.1 m -64.28 -36.63 84.72 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.879 1.272 . . . . 20.0 112.876 -172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.8 t -65.6 -46.03 90.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.186 1.394 . . . . 20.0 110.815 174.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 -40.87 98.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.736 1.614 . . . . 20.0 112.828 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -69.96 -27.78 65.01 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.823 1.649 . . . . 20.0 112.924 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.15 41.72 2.96 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.586 -1.119 . . . . 20.0 113.61 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -120.86 175.27 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.519 1.528 . . . . 20.0 111.72 176.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 171.51 26.68 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 124.913 1.245 . . . . 20.0 113.678 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.8 m -126.77 39.95 3.82 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.052 1.741 . . . . 20.0 111.318 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.74 153.84 20.44 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 20.0 110.934 175.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.45 155.97 65.47 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.618 2.212 . . . . 20.0 111.358 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.64 -20.25 66.17 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.776 1.231 . . . . 20.0 111.696 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -76.16 -8.69 57.59 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.825 1.65 . . . . 20.0 113.224 173.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -118.21 -66.65 1.06 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.618 1.567 . . . . 20.0 110.542 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.24 147.54 98.84 Favored Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 118.299 0.5 . . . . 20.0 112.04 -174.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.11 167.24 27.86 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.525 2.817 . . . . 20.0 111.147 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.52 9.99 8.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.973 1.709 . . . . 20.0 113.236 -170.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -121.45 -34.78 3.38 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 126.52 1.928 . . . . 20.0 113.193 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.04 -7.81 44.16 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.291 1.436 . . . . 20.0 112.973 173.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.03 108.29 4.52 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.611 1.564 . . . . 20.0 111.614 -175.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.8 mt -72.35 169.82 15.49 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.085 1.754 . . . . 20.0 112.797 -176.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.3 p -86.55 -17.71 33.35 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.152 1.381 . . . . 20.0 112.927 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -71.78 171.92 10.76 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.518 1.927 . . . . 20.0 111.913 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.99 149.71 19.64 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 125.313 1.435 . . . . 20.0 110.313 169.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 156.26 23.42 0.03 OUTLIER Glycine 0 CA--C 1.531 1.056 0 CA-C-O 118.633 -1.093 . . . . 20.0 114.004 -176.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.8 m -135.91 176.88 8.28 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.426 1.49 . . . . 20.0 112.115 -172.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -89.4 -19.59 25.0 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.461 1.104 . . . . 20.0 112.302 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -142.37 -66.39 0.39 Allowed 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.19 1.396 . . . . 20.0 110.747 -168.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.87 141.19 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.926 1.29 . . . . 20.0 109.466 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.4 m -78.64 104.44 9.25 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.625 1.17 . . . . 20.0 109.604 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.9 t -100.56 117.2 34.21 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.226 1.01 . . . . 20.0 110.819 -177.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -66.71 99.68 0.63 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.079 1.752 . . . . 20.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.0 mt -74.49 -18.27 60.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.367 1.067 . . . . 20.0 112.943 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.4 t -72.37 -21.68 61.25 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.268 1.027 . . . . 20.0 112.822 -176.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 126.031 1.732 . . . . 20.0 113.58 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.7 mttm . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 119.399 -0.334 . . . . 20.0 111.893 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.2 -7.91 32.89 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.662 2.077 . . . . 20.0 113.066 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.74 156.66 6.22 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.618 1.58 . . . . 20.0 112.531 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -92.41 140.19 29.83 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.038 0.935 . . . . 20.0 110.281 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.94 8.67 22.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.851 1.66 . . . . 20.0 113.092 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.72 150.25 1.3 Allowed Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.389 2.676 . . . . 20.0 113.44 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -64.92 159.84 44.17 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 123.196 2.597 . . . . 20.0 112.849 -170.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 71.7 mt -62.49 -20.51 64.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.342 0.657 . . . . 20.0 112.501 170.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -78.45 -17.62 56.08 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.562 1.545 . . . . 20.0 113.24 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 158.01 33.02 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.642 1.177 . . . . 20.0 110.807 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -70.92 -9.28 57.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.807 1.643 . . . . 20.0 114.641 -174.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.9 m -60.07 154.93 18.11 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 125.336 1.454 . . . . 20.0 111.61 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -154.38 118.32 4.7 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.126 1.37 . . . . 20.0 110.687 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 6.8 tp10 -158.75 -168.67 2.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.248 1.419 . . . . 20.0 109.887 174.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.498 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.9 pp -59.7 158.35 10.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.962 1.705 . . . . 20.0 113.146 171.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -114.84 -10.28 12.38 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.694 1.598 . . . . 20.0 113.291 174.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.15 -56.26 24.35 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 124.058 0.943 . . . . 20.0 112.295 -176.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -85.6 -27.56 25.4 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.893 0.877 . . . . 20.0 112.362 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.48 -32.77 74.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.1 0.96 . . . . 20.0 112.668 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.87 -1.76 0.71 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.507 2.323 . . . . 20.0 115.921 -168.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.6 m -58.66 -22.7 57.6 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.87 1.268 . . . . 20.0 113.594 172.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.43 -8.44 58.49 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.758 1.163 . . . . 20.0 113.793 171.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 89.02 -73.77 2.1 Favored Glycine 0 C--N 1.343 0.935 0 C-N-CA 125.433 1.492 . . . . 20.0 112.306 172.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -133.43 151.64 51.83 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.182 1.793 . . . . 20.0 109.098 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.0 42.45 98.23 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 118.344 -1.253 . . . . 20.0 113.772 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.19 157.92 40.45 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.896 1.278 . . . . 20.0 112.239 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 12.9 ptpt -166.12 132.9 2.63 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.55 1.54 . . . . 20.0 110.512 171.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 156.76 36.33 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.788 0.435 . . . . 20.0 111.207 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.5 t -164.99 13.62 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.736 0.814 . . . . 20.0 112.698 -170.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.1 t . . . . . 0 CA--C 1.538 0.496 0 C-N-CA 125.037 1.335 . . . . 20.0 111.103 -169.523 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 N--CA 1.463 0.214 0 CA-C-O 119.343 -0.361 . . . . 20.0 110.421 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.7 t -62.92 -42.75 99.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.588 0.755 . . . . 20.0 112.327 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.33 -39.82 72.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.01 0.924 . . . . 20.0 110.796 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 t -63.04 -34.05 76.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.822 1.249 . . . . 20.0 112.899 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -74.39 -19.14 60.53 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.795 1.638 . . . . 20.0 112.706 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.37 14.59 35.04 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.945 1.26 . . . . 20.0 114.538 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -75.4 175.04 8.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.765 1.283 . . . . 20.0 112.231 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.5 1.95 13.97 Favored Glycine 0 C--N 1.343 0.962 0 N-CA-C 117.481 1.752 . . . . 20.0 117.481 -160.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m 34.34 61.92 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.266 2.627 . . . . 20.0 113.69 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.5 157.05 87.13 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.296 0.638 . . . . 20.0 109.939 173.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.04 165.39 32.74 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.985 2.457 . . . . 20.0 111.156 174.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -59.87 -38.95 83.66 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.498 0.719 . . . . 20.0 110.664 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 88.9 p -67.38 -10.05 47.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.009 1.724 . . . . 20.0 115.056 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -122.24 -45.05 2.24 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 124.753 1.221 . . . . 20.0 111.001 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.2 t -65.14 119.44 58.89 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.926 1.29 . . . . 20.0 110.331 175.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.15 155.09 72.19 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.357 2.038 . . . . 20.0 110.201 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -69.37 -19.68 63.83 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.215 1.006 . . . . 20.0 112.641 -167.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -74.97 -39.12 61.46 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.76 2.424 . . . . 20.0 112.675 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.47 -9.66 59.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.508 1.123 . . . . 20.0 113.459 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -69.72 117.53 11.43 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 124.007 0.923 . . . . 20.0 110.528 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 mt -88.06 176.38 7.33 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.519 1.528 . . . . 20.0 111.46 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.3 p -105.45 -6.75 19.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.335 1.454 . . . . 20.0 114.004 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.97 172.54 7.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.712 1.205 . . . . 20.0 111.855 175.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.27 177.39 17.2 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.877 1.227 . . . . 20.0 112.771 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.14 -4.1 31.61 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.767 1.651 . . . . 20.0 114.397 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.3 m -77.4 179.85 6.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.233 1.413 . . . . 20.0 112.468 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.7 m -103.16 -11.95 17.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.4 1.08 . . . . 20.0 112.233 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 p -138.32 -71.98 0.41 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.055 1.742 . . . . 20.0 109.654 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -158.36 153.39 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 126.196 1.798 . . . . 20.0 108.724 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 60.9 m -74.26 155.04 38.68 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.519 0.728 . . . . 20.0 111.033 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.9 t -149.32 114.2 5.39 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.394 0.678 . . . . 20.0 110.526 176.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.27 108.58 4.25 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.496 1.118 . . . . 20.0 110.915 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.63 -27.4 58.41 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.763 0.825 . . . . 20.0 113.088 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -73.95 -11.79 60.45 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.084 1.142 . . . . 20.0 114.084 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt . . . . . 0 CA--C 1.541 0.612 0 C-N-CA 127.075 2.15 . . . . 20.0 111.355 179.79 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp . . . . . 0 CA--C 1.536 0.411 0 N-CA-C 112.823 0.675 . . . . 20.0 112.823 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.61 -43.04 1.15 Allowed Glycine 0 C--N 1.339 0.702 0 C-N-CA 125.262 1.41 . . . . 20.0 111.146 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.37 167.58 43.78 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.497 1.523 . . . . 20.0 112.459 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.18 157.85 44.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.503 1.921 . . . . 20.0 110.819 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -82.06 109.36 16.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.152 0.981 . . . . 20.0 109.394 173.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -127.1 155.01 76.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.236 2.214 . . . . 20.0 109.971 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.45 164.78 27.25 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.981 3.121 . . . . 20.0 113.428 -168.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 48.6 mt -59.97 -28.85 68.01 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.518 0.727 . . . . 20.0 111.588 168.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.21 -18.51 65.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.696 1.598 . . . . 20.0 112.725 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -65.98 -30.47 71.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.621 1.168 . . . . 20.0 112.316 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.88 1.11 0.78 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.646 2.378 . . . . 20.0 115.612 173.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.6 p -65.59 167.76 8.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.805 1.242 . . . . 20.0 111.68 172.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -63.68 134.15 54.87 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.253 1.021 . . . . 20.0 110.018 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.96 172.55 12.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.611 1.165 . . . . 20.0 112.116 175.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 162.54 29.47 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.978 2.111 . . . . 20.0 110.979 172.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -88.02 -2.28 58.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.633 1.573 . . . . 20.0 113.336 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.29 -70.2 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.483 1.513 . . . . 20.0 110.742 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -83.98 -27.19 28.63 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.499 0.926 . . . . 20.0 113.499 -176.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.3 p -66.19 -21.94 66.33 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.14 -11.0 35.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.993 1.317 . . . . 20.0 112.685 173.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.6 t -107.34 -30.57 8.62 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.887 1.675 . . . . 20.0 112.198 171.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 75.0 m -61.61 -27.23 68.51 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.368 0.986 . . . . 20.0 112.516 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.5 166.77 42.81 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.249 1.404 . . . . 20.0 112.712 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -62.94 133.84 55.27 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.789 1.236 . . . . 20.0 111.067 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.27 -2.41 65.5 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.162 1.363 . . . . 20.0 113.353 -172.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -149.96 137.8 20.15 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.921 1.361 . . . . 20.0 111.814 -170.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.58 172.37 12.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.642 1.977 . . . . 20.0 112.146 -174.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.89 137.58 51.76 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 122.009 -0.432 . . . . 20.0 109.976 167.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.6 t -138.27 168.33 19.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.783 1.633 . . . . 20.0 108.576 163.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.466 0.33 0 C-N-CA 123.169 0.587 . . . . 20.0 109.966 170.392 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 111.366 0.136 . . . . 20.0 111.366 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.4 t -70.65 -37.42 73.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.542 1.137 . . . . 20.0 112.239 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.31 -37.63 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.305 . . . . 20.0 110.709 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.2 t -58.28 -37.55 75.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.875 1.27 . . . . 20.0 112.075 178.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -77.77 -46.28 22.13 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.518 1.127 . . . . 20.0 111.575 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.59 63.63 2.56 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.419 1.009 . . . . 20.0 112.378 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -95.28 -102.26 0.16 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.57 1.548 . . . . 20.0 108.741 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.58 165.58 35.08 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.153 1.359 . . . . 20.0 111.416 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.9 m -125.45 55.96 1.39 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.276 1.43 . . . . 20.0 110.132 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.42 154.74 90.13 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.074 0.95 . . . . 20.0 109.803 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -69.79 160.08 51.02 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.026 2.484 . . . . 20.0 110.408 170.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.9 -37.31 84.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.768 0.827 . . . . 20.0 112.074 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.0 m -68.72 -21.69 64.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.781 1.03 . . . . 20.0 113.781 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -92.06 -51.13 5.34 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.503 1.121 . . . . 20.0 110.571 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.3 t -62.93 118.51 43.05 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 125.517 1.527 . . . . 20.0 110.941 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.01 155.57 69.13 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.382 2.055 . . . . 20.0 110.206 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -74.08 -16.26 61.04 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.627 1.171 . . . . 20.0 112.72 -165.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.55 -39.82 64.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.649 2.38 . . . . 20.0 112.239 170.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.16 -11.18 59.77 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.612 1.165 . . . . 20.0 113.455 -176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -67.54 112.68 4.83 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.806 0.842 . . . . 20.0 110.694 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.6 mt -78.12 175.99 9.62 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.368 1.867 . . . . 20.0 111.153 174.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.7 p -110.81 -0.25 17.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.719 1.608 . . . . 20.0 112.804 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -72.07 171.57 11.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.73 1.212 . . . . 20.0 111.906 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -129.69 141.84 13.02 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.032 1.301 . . . . 20.0 111.275 174.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 150.09 -14.69 1.0 Allowed Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.763 1.173 . . . . 20.0 114.101 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -77.72 -179.55 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.899 1.35 . . . . 20.0 112.371 172.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.1 t -107.02 -9.53 16.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.496 1.518 . . . . 20.0 111.766 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 p -137.54 -69.61 0.45 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 125.425 1.49 . . . . 20.0 110.158 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.2 p -159.26 144.32 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 20.0 109.86 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 92.4 m -72.99 120.33 18.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.537 1.535 . . . . 20.0 110.173 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.0 t -126.33 108.34 11.15 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.544 1.138 . . . . 20.0 110.607 -171.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -65.04 106.09 1.19 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.54 1.936 . . . . 20.0 111.29 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.2 mt -80.67 -18.2 48.77 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.934 0.894 . . . . 20.0 112.913 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -77.51 -10.57 59.56 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.761 1.225 . . . . 20.0 113.398 -175.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt . . . . . 0 CA--C 1.536 0.427 0 C-N-CA 126.05 1.74 . . . . 20.0 112.998 172.67 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt . . . . . 0 CA--C 1.537 0.45 0 N-CA-C 112.5 0.556 . . . . 20.0 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.6 -24.54 16.8 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.617 1.58 . . . . 20.0 114.094 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.53 -162.66 37.12 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.708 1.147 . . . . 20.0 114.275 173.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -120.99 141.35 50.81 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.121 1.768 . . . . 20.0 109.208 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.9 t -89.05 17.08 6.14 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.928 1.291 . . . . 20.0 113.153 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -43.9 153.02 0.43 Allowed Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 128.92 2.888 . . . . 20.0 114.378 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.85 161.87 44.28 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.618 2.878 . . . . 20.0 112.474 -177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.8 mt -63.62 -18.96 64.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.846 1.258 . . . . 20.0 112.272 172.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -69.45 -25.65 64.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.356 1.463 . . . . 20.0 112.577 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -69.95 160.59 31.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.183 0.993 . . . . 20.0 111.238 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -74.33 97.77 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.381 1.072 . . . . 20.0 110.896 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 98.7 m -153.77 154.84 34.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.782 2.433 . . . . 20.0 109.07 174.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -154.99 92.21 1.43 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.076 1.35 . . . . 20.0 110.394 175.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.483 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.5 tp10 -153.94 -174.7 5.06 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.191 0.996 . . . . 20.0 110.897 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.483 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.5 pp -57.07 158.46 5.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.965 1.706 . . . . 20.0 113.826 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -118.56 -9.11 10.34 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.751 2.021 . . . . 20.0 112.654 175.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -20.0 65.0 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.053 1.341 . . . . 20.0 114.069 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -124.67 -17.92 5.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.344 1.458 . . . . 20.0 111.843 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.5 t -79.29 -20.94 46.76 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.978 1.311 . . . . 20.0 113.498 177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -0.46 5.72 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.239 1.415 . . . . 20.0 114.449 -174.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.6 t -56.64 -45.01 81.85 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.75 1.22 . . . . 20.0 111.602 166.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -69.99 -6.41 33.12 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.485 1.114 . . . . 20.0 113.461 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.21 -166.62 14.57 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.714 1.626 . . . . 20.0 112.389 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.03 46.42 0.39 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.416 1.886 . . . . 20.0 110.537 168.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -150.33 3.99 0.57 Allowed Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.46 1.981 . . . . 20.0 113.329 -173.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -142.61 152.98 43.07 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.675 1.738 . . . . 20.0 110.817 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -132.49 147.98 52.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.582 2.353 . . . . 20.0 108.114 165.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.2 t -60.8 142.74 55.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.848 0.356 . . . . 20.0 111.074 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.9 t -158.17 4.66 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.038 0.755 . . . . 20.0 113.038 -171.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.347 1.459 . . . . 20.0 111.69 -179.047 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 119.341 -0.362 . . . . 20.0 110.698 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 p -68.46 -28.25 66.88 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 114.557 1.317 . . . . 20.0 114.557 -167.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.0 t -57.27 -49.34 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.544 1.138 . . . . 20.0 109.617 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.4 t -71.65 -27.26 62.95 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.733 1.213 . . . . 20.0 112.786 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -67.52 -24.97 65.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.208 1.003 . . . . 20.0 112.419 175.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.23 -1.11 14.52 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.181 1.372 . . . . 20.0 114.176 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -77.95 172.14 13.93 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.753 1.277 . . . . 20.0 112.222 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.9 -7.04 29.73 Favored Glycine 0 C--N 1.341 0.839 0 N-CA-C 118.019 1.968 . . . . 20.0 118.019 -153.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.0 m 37.54 53.93 1.41 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.801 2.44 . . . . 20.0 113.76 -171.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.55 154.25 80.27 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 123.166 0.587 . . . . 20.0 109.646 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.7 161.97 41.41 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.86 2.373 . . . . 20.0 111.256 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -65.64 -18.33 65.24 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.403 0.681 . . . . 20.0 111.604 175.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.7 m -68.29 -43.57 77.42 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.681 1.192 . . . . 20.0 112.231 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -89.4 -48.34 7.4 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.821 0.848 . . . . 20.0 112.285 -174.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.19 118.92 51.28 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.004 1.321 . . . . 20.0 110.683 -176.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -71.06 157.99 56.32 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.916 2.41 . . . . 20.0 110.042 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -73.26 -16.58 61.39 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.0 0.92 . . . . 20.0 112.954 -164.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -72.44 -40.47 67.05 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.174 2.59 . . . . 20.0 112.221 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 -6.78 59.51 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.615 1.566 . . . . 20.0 113.616 -176.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -71.53 101.99 2.6 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 123.868 0.867 . . . . 20.0 111.036 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.73 170.86 7.19 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.085 1.754 . . . . 20.0 111.178 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.6 t -110.47 -3.21 16.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.486 1.514 . . . . 20.0 112.984 -174.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -63.74 175.38 1.13 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.243 1.817 . . . . 20.0 111.85 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.79 178.53 16.35 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.235 1.398 . . . . 20.0 112.754 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.06 -3.85 33.63 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.97 1.271 . . . . 20.0 115.085 171.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.7 m -77.48 176.38 8.94 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.196 1.498 . . . . 20.0 113.143 177.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -85.7 -17.67 35.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.728 -1.124 . . . . 20.0 110.84 166.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -143.08 -70.83 0.32 Allowed 'General case' 0 C--N 1.344 0.357 0 C-N-CA 125.428 1.491 . . . . 20.0 111.783 -168.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -164.88 137.38 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.506 1.522 . . . . 20.0 109.412 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -70.48 128.09 34.95 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.439 1.096 . . . . 20.0 109.491 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.8 t -130.89 114.71 15.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.574 1.149 . . . . 20.0 110.609 -172.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -67.11 121.4 15.53 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.327 0.584 . . . . 20.0 112.138 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.47 -26.22 14.91 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.694 1.198 . . . . 20.0 112.164 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.2 m -68.55 -10.94 58.93 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.397 1.479 . . . . 20.0 114.187 -173.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.3 ptmm? . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 126.419 1.887 . . . . 20.0 113.17 -175.651 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 113.401 0.889 . . . . 20.0 113.401 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 105.67 54.37 0.73 Allowed Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.559 1.076 . . . . 20.0 112.016 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.62 177.5 18.99 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 124.974 1.273 . . . . 20.0 113.357 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.32 157.53 45.42 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.563 1.545 . . . . 20.0 112.581 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -101.28 44.96 0.99 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.13 2.172 . . . . 20.0 111.185 -168.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -63.72 163.88 19.2 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.624 1.97 . . . . 20.0 113.49 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.31 163.46 34.36 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.824 3.016 . . . . 20.0 112.83 -177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.5 mt -68.04 -20.46 64.98 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.656 1.182 . . . . 20.0 112.003 171.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.99 -39.99 96.41 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.928 1.691 . . . . 20.0 111.031 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -74.37 132.45 42.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.305 1.042 . . . . 20.0 109.058 173.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.73 122.83 22.99 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.145 0.578 . . . . 20.0 110.062 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -168.7 166.44 11.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.401 1.48 . . . . 20.0 111.233 176.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -77.58 166.16 23.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.939 1.296 . . . . 20.0 110.665 174.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -132.6 140.65 48.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.449 1.499 . . . . 20.0 110.393 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.1 118.59 16.88 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.785 2.034 . . . . 20.0 110.885 -171.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -63.32 -17.45 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.986 1.314 . . . . 20.0 114.527 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.76 -20.38 61.19 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.95 1.3 . . . . 20.0 113.834 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -139.32 -37.0 0.51 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.97 . . . . 20.0 112.286 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.9 t -69.55 -21.55 63.62 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.749 1.219 . . . . 20.0 112.724 178.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.09 -8.78 18.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.888 0.875 . . . . 20.0 112.822 172.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.7 t -100.49 -26.76 13.74 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.288 1.435 . . . . 20.0 112.436 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 94.3 m -66.38 -44.64 82.57 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.178 0.899 . . . . 20.0 110.632 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 68.75 -179.27 22.87 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.603 1.097 . . . . 20.0 113.487 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -50.12 135.17 21.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.735 1.614 . . . . 20.0 112.398 -176.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.19 -28.58 15.08 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.194 1.854 . . . . 20.0 113.242 -175.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -142.51 -178.79 5.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.5 1.52 . . . . 20.0 111.734 -176.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -165.72 152.59 10.0 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.962 1.305 . . . . 20.0 111.361 -175.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.93 148.16 36.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.252 0.621 . . . . 20.0 110.128 166.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 20.2 t -149.21 140.82 23.44 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.918 1.687 . . . . 20.0 108.292 170.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 CA--C 1.539 0.539 0 C-N-CA 124.927 1.291 . . . . 20.0 109.257 -169.46 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 118.99 -0.529 . . . . 20.0 111.876 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -58.66 -38.51 78.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.269 0.627 . . . . 20.0 110.785 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.14 -43.26 95.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.489 1.516 . . . . 20.0 110.986 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.3 m -63.26 -36.25 83.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.408 1.083 . . . . 20.0 112.41 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.1 -12.06 60.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.875 1.27 . . . . 20.0 112.751 176.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.59 1.19 53.07 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.61 1.576 . . . . 20.0 115.008 173.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -79.54 179.92 7.2 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.61 1.564 . . . . 20.0 111.995 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.1 174.91 15.44 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.603 1.573 . . . . 20.0 113.064 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.3 m -118.24 41.87 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.134 1.374 . . . . 20.0 112.054 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 143.9 97.49 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 122.976 0.51 . . . . 20.0 109.885 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.58 166.62 29.33 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.439 2.759 . . . . 20.0 112.797 -173.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -64.38 -25.74 68.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.564 1.545 . . . . 20.0 112.362 178.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.2 m -77.72 -12.85 60.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.435 1.494 . . . . 20.0 113.815 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.87 -66.97 1.03 Allowed 'General case' 0 C--N 1.344 0.351 0 C-N-CA 124.577 1.151 . . . . 20.0 110.513 -170.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.4 158.54 28.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.462 0.705 . . . . 20.0 112.075 176.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -83.13 170.13 12.38 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.847 3.031 . . . . 20.0 111.892 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -83.77 -5.65 59.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.335 1.454 . . . . 20.0 113.337 -173.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -90.75 -32.43 16.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.82 2.048 . . . . 20.0 112.196 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.02 2.63 12.24 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.909 1.684 . . . . 20.0 113.672 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -85.7 102.73 13.87 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.221 1.008 . . . . 20.0 112.704 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.1 mt -74.77 176.42 7.05 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.346 1.858 . . . . 20.0 111.721 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.9 t -137.2 19.15 2.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.169 1.388 . . . . 20.0 113.226 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.06 -100.71 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.563 1.945 . . . . 20.0 111.176 171.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.16 177.8 28.8 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 128.178 2.799 . . . . 20.0 111.407 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.33 38.0 3.64 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 119.092 -0.838 . . . . 20.0 113.931 176.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 68.9 m -132.8 179.39 6.19 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.556 1.543 . . . . 20.0 111.171 176.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.1 m -108.65 -6.28 16.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.397 1.079 . . . . 20.0 112.284 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.1 p -136.77 -67.79 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.644 1.578 . . . . 20.0 109.852 174.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -165.81 163.2 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 127.75 2.42 . . . . 20.0 107.946 -173.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.8 m -97.49 157.73 15.85 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.556 0.743 . . . . 20.0 111.727 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.3 t -146.34 118.22 8.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.418 1.487 . . . . 20.0 109.94 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.96 96.89 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.424 1.09 . . . . 20.0 113.215 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.7 mt -69.26 -9.01 51.18 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.844 1.258 . . . . 20.0 113.585 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.1 t -101.1 -7.58 23.06 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.966 1.306 . . . . 20.0 112.795 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm . . . . . 0 CA--C 1.535 0.386 0 C-N-CA 125.882 1.673 . . . . 20.0 112.898 -177.89 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 112.753 0.649 . . . . 20.0 112.753 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.66 -14.48 2.92 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.395 1.474 . . . . 20.0 114.407 174.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.67 172.11 48.62 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.353 1.454 . . . . 20.0 112.745 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -136.8 171.34 14.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.591 1.556 . . . . 20.0 111.438 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 57.3 m -74.68 25.09 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.138 2.175 . . . . 20.0 114.565 -172.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -55.46 154.02 13.08 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 125.088 1.355 . . . . 20.0 111.116 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.44 163.11 38.52 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.553 2.835 . . . . 20.0 111.782 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.76 -13.89 62.51 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.08 1.352 . . . . 20.0 112.512 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -68.87 -31.78 70.97 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.209 1.404 . . . . 20.0 111.825 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -72.39 135.05 45.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.596 0.758 . . . . 20.0 109.82 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -80.84 104.28 11.25 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.362 1.465 . . . . 20.0 110.952 -176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.47 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 1.3 m -162.04 165.55 27.13 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.466 1.906 . . . . 20.0 110.274 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -68.48 162.11 26.29 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.37 1.068 . . . . 20.0 111.671 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -133.96 125.11 27.51 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.406 1.482 . . . . 20.0 110.855 -173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.9 pp -129.26 170.96 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.319 2.247 . . . . 20.0 110.817 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.67 -5.4 13.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.762 1.225 . . . . 20.0 112.018 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.6 -34.72 62.89 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.56 1.544 . . . . 20.0 113.131 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -138.34 -36.71 0.58 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.422 1.489 . . . . 20.0 111.855 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.6 p -90.12 48.47 1.57 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.079 1.752 . . . . 20.0 110.441 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -130.06 -7.68 4.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.635 1.974 . . . . 20.0 111.98 177.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.7 m -133.8 84.44 2.12 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.769 1.228 . . . . 20.0 111.354 -176.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.5 t -141.12 -55.72 0.49 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 155.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 160.6 -80.78 0.15 Allowed Glycine 0 C--N 1.341 0.861 0 CA-C-N 118.7 0.682 . . . . 20.0 112.175 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -80.24 65.3 5.35 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 126.443 1.897 . . . . 20.0 110.922 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 45.93 78.85 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 128.464 2.935 . . . . 20.0 112.443 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -63.68 133.84 54.32 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.448 -0.876 . . . . 20.0 109.204 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -142.39 130.64 22.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.115 0.966 . . . . 20.0 111.203 171.387 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.2 t -53.25 120.0 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.46 1.904 . . . . 20.0 111.722 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.9 t -158.97 85.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.743 0.817 . . . . 20.0 110.446 -172.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.48 1.059 0 C-N-CA 124.406 1.082 . . . . 20.0 113.082 -174.848 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 112.098 0.407 . . . . 20.0 112.098 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 t -61.31 -47.05 87.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.349 1.46 . . . . 20.0 111.871 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 88.8 t -77.58 -31.34 17.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.455 1.502 . . . . 20.0 111.411 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.2 m -63.7 -41.92 98.04 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.508 1.123 . . . . 20.0 111.738 173.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.55 -16.61 61.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.05 0.94 . . . . 20.0 112.879 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.64 52.67 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.786 1.184 . . . . 20.0 114.306 172.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -83.73 178.52 7.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.365 1.466 . . . . 20.0 112.321 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.52 175.26 15.67 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.493 1.521 . . . . 20.0 112.449 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.6 m -123.27 52.56 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.297 1.439 . . . . 20.0 111.144 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.65 153.04 88.47 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.008 0.923 . . . . 20.0 109.55 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.85 164.09 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.005 2.47 . . . . 20.0 111.63 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -62.42 -27.8 69.35 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.414 1.486 . . . . 20.0 111.229 172.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.6 m -64.66 -34.06 77.41 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 125.184 1.394 . . . . 20.0 112.473 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.37 -70.08 0.64 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.243 1.017 . . . . 20.0 110.518 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 m -69.94 144.22 92.8 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 124.168 0.987 . . . . 20.0 111.492 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.04 170.64 17.59 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.045 3.164 . . . . 20.0 111.781 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -70.44 -23.49 62.73 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.584 1.154 . . . . 20.0 113.218 -170.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -81.77 -36.88 28.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.265 2.226 . . . . 20.0 112.459 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.86 -8.07 52.14 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.928 1.291 . . . . 20.0 113.486 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -72.15 101.69 2.85 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.115 1.366 . . . . 20.0 110.813 -178.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.93 169.96 10.65 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.123 1.769 . . . . 20.0 111.742 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.6 p -98.17 -11.67 22.54 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.339 1.456 . . . . 20.0 113.743 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -69.42 163.62 24.84 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.437 1.095 . . . . 20.0 112.032 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.55 174.49 15.49 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.207 1.384 . . . . 20.0 111.849 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.29 -3.97 20.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.045 1.307 . . . . 20.0 113.787 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.32 179.41 5.89 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.263 1.425 . . . . 20.0 112.363 175.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -97.46 -13.67 21.61 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.64 1.176 . . . . 20.0 112.042 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -142.94 -71.07 0.32 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.761 1.624 . . . . 20.0 110.33 -173.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -159.1 145.29 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.461 1.104 . . . . 20.0 109.927 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.0 m -77.35 131.83 38.28 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.503 1.121 . . . . 20.0 109.702 169.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.6 t -124.32 118.8 27.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.623 1.169 . . . . 20.0 109.592 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.83 86.18 0.5 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.713 1.205 . . . . 20.0 112.536 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 mt -63.72 -30.97 72.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.517 1.127 . . . . 20.0 112.68 -178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.1 t -64.11 -34.77 78.81 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 123.919 0.888 . . . . 20.0 111.55 177.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 69.1 mttt . . . . . 0 N--CA 1.467 0.381 0 C-N-CA 124.304 1.042 . . . . 20.0 112.759 -174.521 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 107.921 -1.14 . . . . 20.0 107.921 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.0 29.05 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.406 1.003 . . . . 20.0 113.012 -166.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.7 -125.14 3.05 Favored Glycine 0 C--N 1.343 0.942 0 C-N-CA 125.038 1.304 . . . . 20.0 111.513 -174.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.82 167.02 23.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.478 1.111 . . . . 20.0 112.653 -171.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 32.7 t -112.1 82.09 1.57 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.317 1.447 . . . . 20.0 109.937 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.6 164.64 36.63 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 126.04 1.736 . . . . 20.0 111.104 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.94 167.98 20.07 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.587 2.858 . . . . 20.0 112.921 -175.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.3 mt -64.63 -19.82 65.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.315 1.046 . . . . 20.0 112.65 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.29 -27.02 69.05 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.855 1.662 . . . . 20.0 111.926 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -70.46 127.84 34.11 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 125.021 1.328 . . . . 20.0 109.731 -177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -75.29 101.13 4.59 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.415 0.686 . . . . 20.0 110.247 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 p -160.97 -179.98 7.98 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.698 1.599 . . . . 20.0 111.194 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -59.38 165.54 2.72 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.715 2.006 . . . . 20.0 111.648 -177.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -139.44 128.55 23.81 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 125.855 1.662 . . . . 20.0 109.63 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.6 mt -150.79 115.29 5.16 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.422 1.889 . . . . 20.0 109.769 176.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -64.9 -18.93 65.63 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.529 0.936 . . . . 20.0 113.529 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.02 -17.21 60.55 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.964 1.305 . . . . 20.0 114.032 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -129.54 -49.99 1.16 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.707 1.203 . . . . 20.0 112.593 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.5 p -63.73 -18.59 64.19 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.025 1.12 . . . . 20.0 114.025 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.62 -13.5 42.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.467 1.507 . . . . 20.0 113.54 173.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 t -63.28 -46.03 88.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.522 1.129 . . . . 20.0 111.451 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -12.2 57.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.415 0.686 . . . . 20.0 112.539 169.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.61 -162.33 34.43 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.766 1.174 . . . . 20.0 112.664 178.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -74.83 46.46 0.29 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.511 1.924 . . . . 20.0 113.445 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.6 7.94 1.55 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 126.48 1.991 . . . . 20.0 112.528 173.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -144.86 161.74 38.56 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.848 1.259 . . . . 20.0 110.642 176.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.05 149.1 34.49 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.391 2.676 . . . . 20.0 108.444 173.136 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.6 t -52.64 109.0 0.35 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.854 0.862 . . . . 20.0 111.268 -173.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.36 18.29 13.68 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.154 0.982 . . . . 20.0 113.228 -167.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 C--N 1.343 0.3 0 C-N-CA 125.356 1.463 . . . . 20.0 107.995 -170.24 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 111.657 0.243 . . . . 20.0 111.657 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -58.4 -54.78 43.11 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.324 1.45 . . . . 20.0 111.279 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 50.9 t -67.52 -34.4 68.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.119 1.368 . . . . 20.0 111.066 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.9 t -62.42 -41.48 98.72 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.101 1.361 . . . . 20.0 111.589 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -76.04 -14.02 60.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.609 1.164 . . . . 20.0 113.03 175.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.51 -2.03 53.41 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.781 1.658 . . . . 20.0 113.867 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -76.66 176.98 7.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.383 1.473 . . . . 20.0 111.714 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.79 176.45 18.16 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.886 1.232 . . . . 20.0 111.986 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -124.82 76.39 1.51 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.775 1.23 . . . . 20.0 108.702 172.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -77.53 156.1 81.0 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.339 1.056 . . . . 20.0 109.534 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.94 160.13 51.09 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.5 2.134 . . . . 20.0 111.34 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -64.75 -20.85 66.59 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.986 0.914 . . . . 20.0 112.715 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.0 t -68.11 -55.72 11.45 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.017 0.927 . . . . 20.0 110.896 172.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.03 -54.97 9.3 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.45 1.1 . . . . 20.0 111.775 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 t -62.35 115.86 19.02 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.363 1.065 . . . . 20.0 110.889 -177.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -69.04 156.45 65.18 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.785 2.323 . . . . 20.0 110.592 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -72.84 -17.0 61.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.819 0.848 . . . . 20.0 112.977 -166.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 4.7 pt-20 -72.61 -40.91 66.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.288 2.635 . . . . 20.0 111.97 173.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.37 -10.68 59.75 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.036 1.334 . . . . 20.0 112.937 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -66.46 119.5 11.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.202 1.001 . . . . 20.0 110.78 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -90.54 172.82 8.43 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.025 1.33 . . . . 20.0 110.715 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 t -87.54 -14.79 39.28 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.809 1.244 . . . . 20.0 112.204 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -63.64 165.34 8.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.408 1.483 . . . . 20.0 112.538 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.83 -168.77 11.9 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.177 1.37 . . . . 20.0 113.343 -171.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.2 -11.11 73.12 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.224 1.869 . . . . 20.0 113.421 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 77.2 m -67.17 172.23 4.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.62 1.168 . . . . 20.0 111.748 174.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.2 p -106.33 -5.77 18.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.097 1.759 . . . . 20.0 113.533 173.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -139.36 -72.64 0.39 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.266 1.827 . . . . 20.0 109.993 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -164.11 155.32 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.982 1.713 . . . . 20.0 109.002 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -76.02 160.02 30.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.883 0.873 . . . . 20.0 110.403 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.95 117.97 5.9 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.952 0.501 . . . . 20.0 110.825 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -71.74 93.74 1.31 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.805 1.242 . . . . 20.0 110.377 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.95 -22.28 64.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.452 1.101 . . . . 20.0 112.888 -177.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.0 t -74.14 -15.52 61.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.746 1.218 . . . . 20.0 113.023 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? . . . . . 0 CA--C 1.534 0.338 0 C-N-CA 125.767 1.627 . . . . 20.0 113.243 175.994 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt . . . . . 0 N--CA 1.466 0.355 0 N-CA-C 111.819 0.303 . . . . 20.0 111.819 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 151.23 -25.25 0.99 Allowed Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.456 1.503 . . . . 20.0 112.881 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 98.86 156.57 29.24 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.637 1.589 . . . . 20.0 111.192 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -137.42 136.02 37.45 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 125.159 1.383 . . . . 20.0 109.34 -179.044 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.8 m -82.56 94.89 7.6 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.405 0.682 . . . . 20.0 109.518 174.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.63 154.7 60.12 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 125.809 1.643 . . . . 20.0 110.858 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -68.39 156.48 65.49 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.676 2.917 . . . . 20.0 112.362 -170.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.91 -19.84 65.8 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.595 0.758 . . . . 20.0 112.665 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -69.04 -27.02 65.27 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.929 1.692 . . . . 20.0 112.577 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -76.38 134.32 39.68 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.335 0.654 . . . . 20.0 109.993 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.15 99.22 0.87 Allowed 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.631 1.172 . . . . 20.0 110.157 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.33 173.43 8.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.866 1.266 . . . . 20.0 111.472 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -68.25 166.95 15.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.534 1.133 . . . . 20.0 111.439 177.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -142.95 140.19 31.0 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.188 1.795 . . . . 20.0 109.447 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.48 87.75 1.74 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.354 1.461 . . . . 20.0 111.337 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -68.18 -9.57 47.79 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.749 1.018 . . . . 20.0 113.749 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.43 -7.62 40.97 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.547 1.539 . . . . 20.0 113.534 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.25 -56.78 0.65 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.922 1.289 . . . . 20.0 111.047 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 t -66.27 -20.55 66.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.221 1.408 . . . . 20.0 113.184 -176.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.63 -6.65 1.21 Allowed 'General case' 0 C--N 1.344 0.365 0 C-N-CA 126.966 2.106 . . . . 20.0 114.963 -178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.1 t -54.58 -28.84 48.97 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.391 0.996 . . . . 20.0 113.362 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 68' ' ' GLN . 1.3 m -71.4 -75.69 0.12 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.22 1.008 . . . . 20.0 109.142 165.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 145.13 -62.64 0.47 Allowed Glycine 0 C--N 1.347 1.144 0 C-N-CA 123.918 0.771 . . . . 20.0 112.463 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 144.12 50.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.982 1.313 . . . . 20.0 110.291 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 55.59 46.92 80.19 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.037 1.303 . . . . 20.0 113.069 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.426 ' HB2' ' HB2' ' A' ' 64' ' ' CYS . 5.1 pm0 -127.5 -0.11 6.23 Favored 'General case' 0 C--N 1.347 0.471 0 N-CA-C 118.837 2.902 . . . . 20.0 118.837 -165.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -41.15 127.3 2.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.113 2.165 . . . . 20.0 113.981 -168.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 44.4 t -60.49 111.93 1.78 Allowed 'General case' 0 C--N 1.345 0.388 0 C-N-CA 123.904 0.881 . . . . 20.0 109.751 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.6 t -130.17 83.43 2.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.957 1.303 . . . . 20.0 108.332 -174.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 CA--C 1.529 0.166 0 C-N-CA 126.016 1.727 . . . . 20.0 108.276 -177.029 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.964 0.727 . . . . 20.0 112.964 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.7 t -63.4 -35.99 82.23 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.473 1.109 . . . . 20.0 111.895 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.4 t -76.74 -41.95 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.376 1.47 . . . . 20.0 110.634 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.6 m -62.17 -38.65 89.87 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.88 1.272 . . . . 20.0 112.743 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -71.67 -15.94 62.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.736 1.214 . . . . 20.0 113.085 175.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.67 -1.07 56.77 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 125.211 1.386 . . . . 20.0 114.535 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -74.59 176.71 6.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.465 1.132 . . . . 20.0 111.333 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 178.65 19.18 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.049 1.309 . . . . 20.0 112.57 -176.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -131.63 68.31 1.5 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.383 1.473 . . . . 20.0 109.67 176.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.54 155.75 87.88 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 109.238 -0.653 . . . . 20.0 109.238 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.79 166.7 28.7 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.7 2.267 . . . . 20.0 111.018 174.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -63.64 -22.49 66.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.602 0.761 . . . . 20.0 111.753 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -74.04 -16.39 61.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.434 1.494 . . . . 20.0 113.899 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -126.1 -37.92 2.21 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.894 1.278 . . . . 20.0 112.597 -174.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -71.22 125.89 91.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 123.861 0.864 . . . . 20.0 110.039 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -69.12 153.53 71.74 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.688 2.258 . . . . 20.0 109.752 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -73.44 -14.4 61.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.361 1.065 . . . . 20.0 112.955 -167.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.434 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.7 pt-20 -76.56 -42.08 44.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.693 2.397 . . . . 20.0 112.226 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.9 -11.5 59.82 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.808 1.243 . . . . 20.0 113.577 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -67.34 108.07 2.63 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.301 1.04 . . . . 20.0 111.127 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.6 mt -76.07 172.39 12.86 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.883 1.273 . . . . 20.0 112.334 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 55.9 m -90.51 -11.22 40.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.192 1.397 . . . . 20.0 112.953 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -71.71 175.06 6.0 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.799 1.24 . . . . 20.0 112.96 -176.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.21 177.52 18.17 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.524 1.535 . . . . 20.0 112.681 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.34 -11.06 26.36 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.972 1.749 . . . . 20.0 113.373 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.2 m -74.67 178.36 5.47 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.395 1.478 . . . . 20.0 112.263 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 m -115.55 -5.17 12.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.164 1.386 . . . . 20.0 112.322 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -138.75 -74.63 0.38 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.683 1.993 . . . . 20.0 109.204 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -161.1 158.83 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 126.636 1.974 . . . . 20.0 108.271 179.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 31.8 m -75.18 163.07 27.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.808 0.843 . . . . 20.0 111.358 171.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.87 118.66 5.77 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.194 0.997 . . . . 20.0 110.084 170.388 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -69.3 100.45 1.34 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.811 1.245 . . . . 20.0 109.547 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 mt -67.95 -24.95 65.23 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.318 1.047 . . . . 20.0 112.267 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.8 t -74.93 -5.7 45.21 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.153 1.381 . . . . 20.0 112.499 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.2 mttt . . . . . 0 N--CA 1.467 0.425 0 C-N-CA 125.934 1.694 . . . . 20.0 111.981 174.479 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt . . . . . 0 CA--C 1.532 0.27 0 N-CA-C 108.72 -0.844 . . . . 20.0 108.72 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.56 -49.03 0.02 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.838 1.209 . . . . 20.0 111.705 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.39 101.11 0.69 Allowed Glycine 0 C--N 1.342 0.89 0 C-N-CA 124.454 1.026 . . . . 20.0 111.271 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.18 150.31 47.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.872 0.869 . . . . 20.0 111.472 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.4 t -110.87 28.66 8.49 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.821 1.648 . . . . 20.0 111.711 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -45.14 149.8 0.86 Allowed Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 127.809 2.444 . . . . 20.0 113.821 159.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.88 159.45 41.73 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.12 3.213 . . . . 20.0 112.84 -171.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.33 -18.78 64.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.332 1.053 . . . . 20.0 113.759 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.09 -29.8 67.97 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.994 1.318 . . . . 20.0 112.624 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -73.06 138.91 46.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.571 0.748 . . . . 20.0 110.664 -175.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -71.73 104.27 3.34 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.204 1.401 . . . . 20.0 111.329 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -163.5 177.99 8.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.034 1.734 . . . . 20.0 110.077 173.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -69.0 162.49 26.71 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.653 1.181 . . . . 20.0 110.814 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -148.32 134.76 19.62 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.785 1.234 . . . . 20.0 109.978 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.8 mt -146.18 110.91 5.19 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 126.594 1.958 . . . . 20.0 108.729 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.95 -21.67 66.24 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.114 0.783 . . . . 20.0 113.114 -176.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.05 -35.74 74.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.429 1.092 . . . . 20.0 112.185 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -108.24 -31.19 7.99 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.881 1.273 . . . . 20.0 111.89 -170.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.8 p -84.1 -4.8 59.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.283 1.433 . . . . 20.0 113.828 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.3 -9.1 37.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.454 1.102 . . . . 20.0 113.012 174.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.7 t -60.86 -56.34 22.28 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.529 1.532 . . . . 20.0 112.258 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -79.31 -12.45 59.93 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.805 0.73 . . . . 20.0 112.184 172.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.19 -164.81 44.43 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.741 1.162 . . . . 20.0 112.588 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -54.76 107.56 0.3 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.096 1.758 . . . . 20.0 111.635 177.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 134.18 -17.7 4.29 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.288 1.423 . . . . 20.0 112.824 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -110.59 147.99 33.09 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-N 118.967 1.383 . . . . 20.0 111.017 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -132.17 153.81 50.18 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.141 1.777 . . . . 20.0 109.706 175.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.2 t -66.89 96.77 0.44 Allowed 'General case' 0 C--N 1.346 0.443 0 C-N-CA 124.581 1.152 . . . . 20.0 110.92 -176.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 10.8 t -143.39 111.49 6.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.073 1.349 . . . . 20.0 109.811 -176.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 CA--C 1.534 0.347 0 C-N-CA 124.049 0.94 . . . . 20.0 110.302 177.439 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 . . . . . 0 CA--C 1.536 0.411 0 N-CA-C 110.476 -0.194 . . . . 20.0 110.476 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 m -68.64 -27.57 66.12 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.98 1.712 . . . . 20.0 112.774 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.2 -53.3 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.175 1.39 . . . . 20.0 109.981 169.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 t -61.77 -33.53 74.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.237 1.015 . . . . 20.0 112.274 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -72.91 -56.77 4.7 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.566 1.146 . . . . 20.0 110.561 173.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.22 53.07 0.4 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.497 1.522 . . . . 20.0 112.978 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -116.98 179.71 3.94 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.671 1.589 . . . . 20.0 111.396 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.28 168.4 19.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.218 0.914 . . . . 20.0 112.697 -175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.8 m -120.58 83.93 2.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.235 1.414 . . . . 20.0 108.897 174.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -98.78 155.65 36.45 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.669 1.188 . . . . 20.0 108.468 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.86 162.15 42.83 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.652 2.235 . . . . 20.0 111.184 173.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -62.23 -28.42 69.68 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.7 1.2 . . . . 20.0 111.329 173.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -73.2 -16.14 61.43 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.719 1.208 . . . . 20.0 113.818 175.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -97.39 -66.27 0.91 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.415 1.086 . . . . 20.0 110.34 175.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.6 m -72.0 143.18 86.11 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.876 0.87 . . . . 20.0 111.234 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.21 173.38 13.09 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 124.384 3.389 . . . . 20.0 111.178 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -74.04 7.77 2.47 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.564 1.546 . . . . 20.0 113.841 -172.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -123.54 -38.13 2.57 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.624 1.97 . . . . 20.0 112.699 -172.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.59 -15.4 63.41 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.339 1.056 . . . . 20.0 113.304 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.77 109.86 3.54 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 126.118 1.767 . . . . 20.0 110.421 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.35 169.58 17.37 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.393 1.477 . . . . 20.0 111.683 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -103.22 -6.64 21.9 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.103 1.361 . . . . 20.0 112.813 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.44 176.07 1.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.881 1.672 . . . . 20.0 111.215 167.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.34 174.49 22.85 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 123.865 0.745 . . . . 20.0 113.6 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.03 -4.42 20.5 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 126.182 1.849 . . . . 20.0 114.384 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.3 m -73.22 -177.52 2.56 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.68 1.24 . . . . 20.0 111.471 165.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.1 m -99.52 -10.69 21.82 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.813 0.845 . . . . 20.0 111.899 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.4 p -138.95 -70.68 0.41 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.955 1.702 . . . . 20.0 109.513 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -157.47 144.37 9.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.117 1.367 . . . . 20.0 109.186 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.45 132.92 35.34 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.482 0.713 . . . . 20.0 109.619 173.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.8 t -126.19 114.93 18.98 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.961 1.304 . . . . 20.0 109.613 -174.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -67.38 99.83 0.77 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 124.788 1.235 . . . . 20.0 110.106 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.4 mt -68.73 -27.89 66.33 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.303 1.041 . . . . 20.0 112.149 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -72.98 -10.12 59.46 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.053 1.341 . . . . 20.0 112.957 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mttt . . . . . 0 CA--C 1.539 0.549 0 C-N-CA 125.613 1.565 . . . . 20.0 111.175 174.35 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 110.173 -0.306 . . . . 20.0 110.173 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 161.63 -15.79 0.16 Allowed Glycine 0 CA--C 1.534 1.277 0 CA-C-O 118.63 -1.094 . . . . 20.0 114.468 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.98 176.4 37.98 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.618 1.209 . . . . 20.0 113.449 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -145.59 157.64 43.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.61 1.164 . . . . 20.0 110.924 177.238 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.5 t -86.62 22.5 1.89 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.422 2.289 . . . . 20.0 112.127 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -58.93 148.91 68.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.893 1.277 . . . . 20.0 111.049 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.75 166.09 28.75 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 124.242 3.295 . . . . 20.0 113.469 -166.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.72 -23.85 65.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.378 1.071 . . . . 20.0 112.605 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -71.92 -13.03 61.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.261 1.424 . . . . 20.0 113.085 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.3 tpt85 -78.71 153.52 30.82 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.518 1.127 . . . . 20.0 110.269 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -102.68 101.63 11.76 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.533 1.133 . . . . 20.0 109.443 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 p -169.63 161.44 9.43 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.176 1.79 . . . . 20.0 111.077 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -80.88 110.14 16.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.087 1.755 . . . . 20.0 111.447 -173.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -79.6 151.41 30.63 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.46 0.704 . . . . 20.0 110.573 168.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.79 16.48 2.5 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.895 1.678 . . . . 20.0 114.54 175.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 51.85 21.37 1.42 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 130.251 3.42 . . . . 20.0 116.989 169.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -129.3 -71.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.271 1.429 . . . . 20.0 110.402 -167.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -63.47 -36.69 84.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 20.0 111.23 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.2 t -69.12 -32.03 71.15 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.18 1.792 . . . . 20.0 113.441 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.35 -7.06 16.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.009 1.324 . . . . 20.0 114.341 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.8 m -59.65 -42.6 93.16 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.227 1.411 . . . . 20.0 111.844 171.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 19.4 m -79.13 -11.47 59.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.839 1.256 . . . . 20.0 113.331 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 88.57 -98.83 2.47 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 125.319 1.438 . . . . 20.0 111.467 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -132.08 161.5 33.1 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.749 1.619 . . . . 20.0 110.588 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.63 -8.3 74.31 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.965 1.269 . . . . 20.0 113.598 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -123.75 178.61 5.15 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.849 1.66 . . . . 20.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -146.18 162.89 37.02 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.134 1.774 . . . . 20.0 110.537 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.65 123.27 17.45 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 107.738 -1.208 . . . . 20.0 107.738 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.1 t -140.03 105.83 5.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.272 0.629 . . . . 20.0 109.875 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.981 1.312 . . . . 20.0 109.345 179.855 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 N--CA 1.463 0.186 0 CA-C-O 119.351 -0.357 . . . . 20.0 111.487 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.2 m -61.92 -34.89 76.89 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.477 0.711 . . . . 20.0 111.392 176.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.29 -49.55 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.282 1.433 . . . . 20.0 110.367 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 t -63.89 -33.41 75.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.98 1.312 . . . . 20.0 112.455 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -82.4 -8.25 59.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.52 1.528 . . . . 20.0 113.104 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.29 15.32 41.69 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.558 1.075 . . . . 20.0 114.512 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -100.34 -177.57 3.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.052 1.741 . . . . 20.0 111.695 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.3 170.08 15.62 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.28 1.419 . . . . 20.0 112.525 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.6 m -113.62 78.84 1.18 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.006 1.322 . . . . 20.0 109.834 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.13 156.78 74.07 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.972 0.909 . . . . 20.0 109.491 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.05 161.65 45.19 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.771 2.314 . . . . 20.0 110.694 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -64.06 -29.92 71.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.898 0.879 . . . . 20.0 111.17 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 t -62.66 -36.15 81.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.613 1.165 . . . . 20.0 112.542 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -86.89 -58.09 2.73 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.943 0.897 . . . . 20.0 111.047 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.9 t -67.42 118.48 57.1 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.955 1.302 . . . . 20.0 110.978 -176.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -71.46 162.25 42.9 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.321 2.681 . . . . 20.0 110.845 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.52 -14.69 61.26 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.427 1.091 . . . . 20.0 113.461 -166.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.38 -34.04 65.34 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 128.226 2.61 . . . . 20.0 112.244 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.12 -6.43 38.44 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.197 1.799 . . . . 20.0 114.104 -173.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.52 105.53 3.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.079 0.951 . . . . 20.0 110.434 177.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.36 169.44 12.31 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.494 . . . . 20.0 111.808 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.3 t -93.8 -15.04 25.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.781 1.233 . . . . 20.0 112.677 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 22.9 m-85 -63.57 170.61 3.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.703 1.601 . . . . 20.0 111.491 170.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -147.25 -178.65 22.69 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.134 0.874 . . . . 20.0 113.587 -176.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.66 -13.18 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.627 2.061 . . . . 20.0 113.65 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 87.8 m -69.32 176.29 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.57 1.548 . . . . 20.0 112.909 179.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.3 t -90.64 -15.68 30.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.65 0.78 . . . . 20.0 111.077 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.4 p -137.69 -74.78 0.41 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 20.0 109.65 -176.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -161.98 161.06 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.236 1.814 . . . . 20.0 108.525 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.8 m -92.29 162.55 14.24 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.435 0.694 . . . . 20.0 110.965 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -146.85 121.15 9.58 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.013 0.925 . . . . 20.0 109.378 177.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -70.79 92.74 0.91 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.944 0.897 . . . . 20.0 111.563 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -64.11 -30.26 71.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.842 1.257 . . . . 20.0 112.485 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.7 p -71.23 -7.72 48.74 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.943 1.697 . . . . 20.0 113.507 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 77.1 mttt . . . . . 0 CA--C 1.536 0.416 0 C-N-CA 125.387 1.475 . . . . 20.0 112.862 -179.683 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 113.852 1.056 . . . . 20.0 113.852 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.1 -22.37 36.9 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.612 1.577 . . . . 20.0 114.012 174.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.67 173.97 43.73 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.677 1.608 . . . . 20.0 114.183 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -138.16 169.06 18.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.144 1.378 . . . . 20.0 112.99 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 12.0 t -95.8 33.91 1.6 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.032 2.133 . . . . 20.0 112.164 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.44 156.11 44.05 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.633 1.573 . . . . 20.0 112.895 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.46 159.42 44.4 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.711 3.607 . . . . 20.0 112.08 -171.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.2 -21.14 64.88 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.019 1.328 . . . . 20.0 112.518 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.29 -25.33 66.8 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.743 1.617 . . . . 20.0 112.836 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.55 150.97 42.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.817 1.247 . . . . 20.0 110.536 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -134.02 102.47 5.43 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.906 1.282 . . . . 20.0 109.188 -179.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.39 -87.73 0.08 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.444 1.897 . . . . 20.0 107.739 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -146.57 165.82 28.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.203 1.801 . . . . 20.0 109.302 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.96 163.53 32.72 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.977 0.911 . . . . 20.0 111.238 170.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.2 tp -169.23 109.92 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 107.498 -1.297 . . . . 20.0 107.498 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -67.1 -18.93 65.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.305 1.442 . . . . 20.0 114.147 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.7 -27.7 66.67 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.005 1.113 . . . . 20.0 114.005 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -127.5 -30.56 2.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.767 1.227 . . . . 20.0 111.832 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 54.7 p -70.46 -22.65 62.66 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.894 1.072 . . . . 20.0 113.894 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.28 -6.38 6.79 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.617 1.567 . . . . 20.0 114.412 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m -126.45 67.81 1.23 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.552 1.541 . . . . 20.0 109.401 167.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.86 -27.72 2.06 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.002 1.321 . . . . 20.0 113.934 171.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.62 -92.15 0.23 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 124.836 1.207 . . . . 20.0 111.923 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -77.13 41.33 0.29 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.97 2.108 . . . . 20.0 112.828 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.72 60.07 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 C-N-CA 123.75 0.69 . . . . 20.0 113.429 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -86.03 79.76 9.07 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 123.069 1.414 . . . . 20.0 111.314 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.66 119.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 128.395 2.678 . . . . 20.0 110.031 166.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -72.72 88.37 1.29 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.056 0.455 . . . . 20.0 110.807 176.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 26.4 t -81.53 132.77 35.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.459 1.904 . . . . 20.0 110.263 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 123.523 0.729 . . . . 20.0 110.379 174.026 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 . . . . . 0 N--CA 1.462 0.145 0 CA-C-O 119.393 -0.337 . . . . 20.0 110.3 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.7 m -62.74 -36.47 83.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.708 1.203 . . . . 20.0 111.523 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.14 -43.49 95.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.508 1.523 . . . . 20.0 110.013 174.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 t -62.6 -38.41 90.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.082 0.953 . . . . 20.0 111.839 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -70.75 -30.07 66.48 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.484 1.114 . . . . 20.0 112.16 176.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.72 -2.23 23.17 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.771 1.653 . . . . 20.0 114.619 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -71.98 -179.15 2.63 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.349 1.86 . . . . 20.0 112.277 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.81 171.9 18.43 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 124.785 1.184 . . . . 20.0 113.195 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -113.2 82.35 1.65 Allowed 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.68 1.592 . . . . 20.0 109.837 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -86.64 156.04 56.12 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.408 1.083 . . . . 20.0 109.253 173.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.31 164.69 34.88 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.741 2.294 . . . . 20.0 110.809 170.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -64.52 -25.61 68.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.757 1.223 . . . . 20.0 112.013 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 t -69.59 -36.39 76.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.287 1.035 . . . . 20.0 112.124 177.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -86.62 -52.84 5.3 Favored 'General case' 0 C--N 1.344 0.349 0 C-N-CA 124.151 0.98 . . . . 20.0 111.475 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.1 t -67.2 119.33 63.93 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 124.36 1.064 . . . . 20.0 110.497 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -69.45 158.42 57.43 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.807 2.338 . . . . 20.0 110.321 175.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -73.44 -16.34 61.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.357 1.063 . . . . 20.0 112.878 -165.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.55 -40.75 48.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.597 2.359 . . . . 20.0 111.772 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.23 -4.71 51.93 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.872 1.669 . . . . 20.0 113.833 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.94 107.9 5.57 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 124.275 1.03 . . . . 20.0 110.84 -179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.04 170.65 10.95 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.911 1.684 . . . . 20.0 112.196 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 t -99.78 -11.11 21.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.571 1.548 . . . . 20.0 112.55 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -65.24 174.61 1.98 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.226 1.811 . . . . 20.0 111.306 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.92 176.75 25.64 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.669 0.652 . . . . 20.0 113.406 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.07 -12.71 17.03 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.136 1.826 . . . . 20.0 113.862 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -69.01 175.86 3.49 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.725 1.262 . . . . 20.0 112.323 173.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.6 p -85.07 -22.85 28.8 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 124.529 1.132 . . . . 20.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 p -140.9 -67.71 0.41 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.086 1.354 . . . . 20.0 110.297 -170.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.7 147.47 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 125.179 1.392 . . . . 20.0 109.862 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.9 m -87.32 131.02 34.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.741 1.216 . . . . 20.0 110.129 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 t -124.6 127.55 47.54 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.517 1.127 . . . . 20.0 109.701 -174.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -76.75 80.95 3.36 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.903 0.881 . . . . 20.0 113.3 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.62 -26.82 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.531 1.532 . . . . 20.0 113.95 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.6 m -67.3 -18.68 65.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.347 1.059 . . . . 20.0 113.048 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 pttt . . . . . 0 CA--C 1.533 0.323 0 C-N-CA 125.78 1.632 . . . . 20.0 113.545 -176.32 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.1 mttt . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 113.779 1.029 . . . . 20.0 113.779 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 137.61 20.3 0.55 Allowed Glycine 0 CA--C 1.53 0.998 0 CA-C-O 118.805 -0.997 . . . . 20.0 114.185 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.61 -161.19 3.68 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.536 1.541 . . . . 20.0 113.986 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -139.82 140.62 36.65 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.153 1.381 . . . . 20.0 110.593 -172.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.43 122.25 32.45 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.559 0.744 . . . . 20.0 109.956 165.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -137.45 154.97 75.68 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.81 2.044 . . . . 20.0 110.035 173.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.81 164.99 19.76 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.724 3.616 . . . . 20.0 114.409 -165.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.23 -15.04 30.53 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.163 1.385 . . . . 20.0 113.834 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -88.91 -6.55 57.22 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.425 1.49 . . . . 20.0 113.922 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -67.28 -22.26 65.66 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.588 1.155 . . . . 20.0 114.107 -170.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 67.06 1.8 2.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.458 1.903 . . . . 20.0 114.525 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -63.58 -87.83 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.26 1.824 . . . . 20.0 112.207 -175.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -153.79 161.45 42.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.634 1.974 . . . . 20.0 109.121 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -128.24 141.23 51.52 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.781 2.032 . . . . 20.0 109.684 176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 68.0 mt -139.7 105.22 5.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.518 1.927 . . . . 20.0 108.889 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -63.54 -20.85 65.96 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.822 1.192 . . . . 20.0 113.46 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.06 -15.96 60.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.814 1.246 . . . . 20.0 113.983 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -129.83 -44.88 1.18 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.712 1.205 . . . . 20.0 112.138 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 m -66.47 -28.98 69.01 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 125.202 1.401 . . . . 20.0 113.228 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.11 -14.97 58.53 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.4 . . . . 20.0 112.992 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.4 m -68.44 -51.02 48.26 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 125.533 1.533 . . . . 20.0 111.616 173.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 23.3 m -69.1 -26.75 65.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.922 0.889 . . . . 20.0 111.517 169.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.24 -179.06 19.36 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.729 1.633 . . . . 20.0 113.278 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.33 45.3 0.37 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.282 2.633 . . . . 20.0 113.194 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -143.49 -2.72 0.91 Allowed Glycine 0 CA--C 1.535 1.311 0 C-N-CA 126.972 2.225 . . . . 20.0 113.018 176.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -135.87 171.21 14.79 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.048 1.424 . . . . 20.0 111.297 176.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -144.34 120.44 10.77 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.308 2.243 . . . . 20.0 110.509 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -81.09 125.49 30.28 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.262 1.425 . . . . 20.0 112.027 -165.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 35.8 m -71.99 -12.58 61.3 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 115.006 1.484 . . . . 20.0 115.006 -179.411 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 124.454 1.101 . . . . 20.0 112.069 -173.91 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.593 0.59 . . . . 20.0 112.593 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -63.79 -33.9 76.7 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.993 . . . . 20.0 111.754 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -42.6 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 125.274 1.43 . . . . 20.0 110.843 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 t -59.52 -45.03 92.93 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.864 1.666 . . . . 20.0 111.889 -177.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -69.06 -13.06 62.22 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.808 1.243 . . . . 20.0 113.443 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.28 5.75 57.95 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 125.4 1.476 . . . . 20.0 114.036 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -81.01 177.29 9.15 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.271 1.028 . . . . 20.0 112.011 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.97 177.05 18.0 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.235 1.398 . . . . 20.0 112.222 -174.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.4 m -131.24 71.91 1.49 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.922 1.289 . . . . 20.0 110.27 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.87 159.21 83.52 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.832 1.253 . . . . 20.0 109.696 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.73 161.04 47.48 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.391 2.061 . . . . 20.0 110.65 172.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.61 -21.47 66.72 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.0 0.92 . . . . 20.0 111.779 176.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.4 m -71.01 -17.98 62.61 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.541 1.536 . . . . 20.0 114.167 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.76 -46.12 2.66 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.558 1.143 . . . . 20.0 111.319 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.4 t -66.61 119.03 59.93 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 123.53 0.732 . . . . 20.0 110.537 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -71.33 161.25 46.29 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.327 2.684 . . . . 20.0 110.477 175.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -76.12 -13.5 60.2 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.416 0.895 . . . . 20.0 113.416 -166.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.07 -42.76 62.72 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.701 2.4 . . . . 20.0 111.794 171.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.72 -9.46 59.43 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.231 1.413 . . . . 20.0 113.482 -175.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.68 102.77 2.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.805 1.242 . . . . 20.0 111.33 -177.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 mt -75.57 167.12 22.5 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.872 1.269 . . . . 20.0 112.166 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -87.67 -12.14 46.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 20.0 112.773 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.89 170.39 11.26 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.744 1.217 . . . . 20.0 111.912 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.12 177.76 17.23 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.113 1.34 . . . . 20.0 112.669 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.03 -8.63 25.23 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.854 1.692 . . . . 20.0 113.53 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.0 m -77.52 175.83 9.47 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.555 1.142 . . . . 20.0 112.42 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -114.2 -5.06 13.02 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.317 1.447 . . . . 20.0 111.99 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.8 p -137.33 -71.83 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.998 1.719 . . . . 20.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -163.65 153.18 2.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.084 1.754 . . . . 20.0 109.42 177.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.94 157.32 38.38 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.853 0.861 . . . . 20.0 111.823 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -153.29 119.1 5.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.009 0.924 . . . . 20.0 110.185 174.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -71.76 90.51 1.09 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.017 0.927 . . . . 20.0 112.587 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.93 -37.61 82.91 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.66 1.184 . . . . 20.0 112.681 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.2 p -73.84 -5.54 41.56 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.872 1.269 . . . . 20.0 113.774 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mtmt . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.505 1.522 . . . . 20.0 113.116 179.972 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 118.934 -0.555 . . . . 20.0 111.518 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.13 68.54 1.46 Allowed Glycine 0 C--N 1.343 0.936 0 N-CA-C 109.788 -1.325 . . . . 20.0 109.788 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.88 165.26 48.64 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.142 0.877 . . . . 20.0 113.645 -174.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 0.6 OUTLIER -86.54 168.23 13.88 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.56 1.144 . . . . 20.0 111.541 -179.54 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 69.7 m -112.55 107.83 16.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.29 1.036 . . . . 20.0 110.27 175.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -129.09 159.14 70.39 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.953 2.101 . . . . 20.0 109.411 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.48 170.86 15.26 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.088 2.525 . . . . 20.0 113.07 -171.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.2 mt -54.14 -35.9 62.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.727 1.211 . . . . 20.0 112.479 169.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -79.84 4.89 15.16 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.81 1.644 . . . . 20.0 113.665 -175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -64.3 -13.23 48.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.186 1.394 . . . . 20.0 113.573 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? 72.29 2.69 4.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.048 2.139 . . . . 20.0 112.976 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 165.92 3.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.313 1.845 . . . . 20.0 111.064 167.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -139.44 92.1 2.55 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 123.922 0.889 . . . . 20.0 110.682 -172.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -154.88 -173.49 4.59 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.39 1.476 . . . . 20.0 110.058 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -55.98 152.58 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.184 1.394 . . . . 20.0 113.02 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -131.64 2.46 4.11 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.641 1.176 . . . . 20.0 112.381 -171.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.09 -78.33 0.18 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.139 1.376 . . . . 20.0 110.916 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -68.77 -33.11 73.34 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.885 1.274 . . . . 20.0 112.437 -175.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.1 m -62.16 -31.16 71.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.116 1.366 . . . . 20.0 112.251 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.5 -9.74 37.64 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 114.866 1.432 . . . . 20.0 114.866 -172.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.9 t -58.34 -16.7 15.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.682 1.593 . . . . 20.0 114.181 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -17.55 53.24 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.19 1.182 . . . . 20.0 114.19 -176.349 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 138.71 -81.02 0.27 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.027 0.822 . . . . 20.0 112.755 171.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.48 59.82 3.05 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.051 1.74 . . . . 20.0 111.965 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 48.93 23.95 4.0 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 129.863 3.601 . . . . 20.0 114.931 -176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -41.69 146.02 0.27 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 128.213 2.605 . . . . 20.0 112.715 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -135.46 133.38 38.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.552 -1.204 . . . . 20.0 109.704 -177.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.45 131.93 29.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 124.314 1.009 . . . . 20.0 110.961 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.9 t -138.9 20.93 2.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.993 1.317 . . . . 20.0 111.525 -171.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 125.044 1.338 . . . . 20.0 109.776 170.786 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 112.999 0.74 . . . . 20.0 112.999 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.7 m -58.05 -52.48 65.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.033 0.933 . . . . 20.0 110.902 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.38 -36.23 77.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.956 1.702 . . . . 20.0 111.414 -176.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 t -64.84 -35.97 82.83 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.674 1.189 . . . . 20.0 111.99 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -77.78 -18.13 56.76 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.543 0.737 . . . . 20.0 111.895 174.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.19 -7.67 35.21 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 126.598 2.047 . . . . 20.0 113.144 177.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -70.4 174.74 5.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.94 1.696 . . . . 20.0 112.279 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.71 -176.5 14.46 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.996 1.284 . . . . 20.0 112.604 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.1 m -125.74 58.55 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.414 1.485 . . . . 20.0 110.758 -173.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.83 156.42 87.11 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 125.035 1.334 . . . . 20.0 110.015 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -70.9 162.73 41.63 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.595 2.197 . . . . 20.0 110.875 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -65.6 -16.62 63.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.572 0.749 . . . . 20.0 111.962 173.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.9 m -72.84 -28.61 62.64 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.506 1.522 . . . . 20.0 113.067 173.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -107.59 -47.87 3.54 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.533 1.133 . . . . 20.0 111.24 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.2 t -65.94 121.04 73.96 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.909 1.284 . . . . 20.0 109.776 172.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.81 170.18 18.45 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.54 2.827 . . . . 20.0 110.499 174.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -77.94 -10.73 59.73 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.658 0.985 . . . . 20.0 113.658 -171.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.8 pt-20 -85.34 -37.46 19.89 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.89 2.076 . . . . 20.0 112.316 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 -2.85 43.12 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.35 1.86 . . . . 20.0 113.657 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.94 97.97 4.12 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 124.571 1.148 . . . . 20.0 110.997 -174.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.89 168.34 13.78 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.967 1.707 . . . . 20.0 111.402 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -85.45 -15.26 43.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.626 1.17 . . . . 20.0 112.971 -177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -66.37 167.67 10.14 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.431 1.492 . . . . 20.0 112.056 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.49 178.44 19.98 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.873 1.225 . . . . 20.0 112.265 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.88 -11.73 29.65 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 125.47 1.509 . . . . 20.0 113.02 -176.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.3 m -67.16 176.33 2.23 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.367 1.467 . . . . 20.0 112.537 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.7 t -101.14 -12.43 18.79 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.722 1.209 . . . . 20.0 111.736 174.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -139.64 -74.04 0.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.939 1.696 . . . . 20.0 109.807 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -163.89 143.42 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 125.047 1.339 . . . . 20.0 109.802 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.7 t -74.26 139.52 44.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.137 0.975 . . . . 20.0 109.704 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -138.3 124.81 20.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.641 0.776 . . . . 20.0 110.712 -175.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -73.09 82.06 1.27 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.046 0.939 . . . . 20.0 112.45 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.44 -31.67 72.89 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.747 1.219 . . . . 20.0 113.134 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -71.85 -11.98 61.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.572 1.149 . . . . 20.0 112.832 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.6 mttm . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 125.8 1.64 . . . . 20.0 112.957 -178.579 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.1 ttpt . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 114.916 1.45 . . . . 20.0 114.916 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 -11.98 70.15 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 126.25 1.881 . . . . 20.0 112.865 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.5 108.66 0.07 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.212 1.863 . . . . 20.0 113.389 174.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.37 179.21 5.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.549 1.14 . . . . 20.0 111.021 168.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.4 t -137.55 57.34 1.74 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.166 0.986 . . . . 20.0 110.686 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.4 159.25 74.07 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.956 1.702 . . . . 20.0 112.08 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.07 164.12 31.32 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.524 2.816 . . . . 20.0 113.117 -176.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.27 -16.23 64.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.855 0.862 . . . . 20.0 112.607 172.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -65.87 -25.63 67.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.176 1.39 . . . . 20.0 112.763 172.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -68.96 148.62 49.88 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.923 0.889 . . . . 20.0 111.089 -175.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.33 9.1 24.45 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.286 1.034 . . . . 20.0 113.272 -178.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.4 t -60.24 169.23 1.69 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.166 1.386 . . . . 20.0 112.011 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -146.39 114.57 6.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.696 1.998 . . . . 20.0 108.354 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -152.96 176.18 12.14 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.291 0.567 . . . . 20.0 112.129 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -58.05 140.45 52.49 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.839 1.656 . . . . 20.0 112.847 174.694 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -75.32 -9.9 58.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.363 1.865 . . . . 20.0 114.235 174.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.29 -71.91 0.28 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.968 0.907 . . . . 20.0 110.858 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' H ' HD12 ' A' ' 57' ' ' LEU . 3.8 mm-40 -65.97 -28.11 68.65 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.114 1.366 . . . . 20.0 113.056 -178.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -66.6 -41.51 88.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.351 0.5 . . . . 20.0 112.351 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.14 -19.74 63.2 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.733 0.813 . . . . 20.0 112.212 174.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.2 m -90.74 -17.27 26.98 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.386 1.474 . . . . 20.0 112.86 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.98 -45.27 74.63 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 125.058 1.343 . . . . 20.0 110.241 176.303 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 142.33 175.4 15.59 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.292 0.948 . . . . 20.0 113.035 170.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -79.54 73.89 6.21 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.918 1.287 . . . . 20.0 109.204 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 162.32 -18.1 0.16 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.042 1.306 . . . . 20.0 113.127 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -146.57 174.42 11.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.534 1.533 . . . . 20.0 112.288 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -157.06 162.94 39.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.011 1.724 . . . . 20.0 112.122 -171.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -69.05 153.06 44.41 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 118.213 0.461 . . . . 20.0 110.481 169.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.9 t -152.56 159.07 43.3 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.384 1.474 . . . . 20.0 109.886 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.546 0.797 0 C-N-CA 127.104 2.161 . . . . 20.0 107.53 175.187 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 111.318 0.118 . . . . 20.0 111.318 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.0 t -65.28 -41.4 94.21 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.337 1.455 . . . . 20.0 112.098 -177.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 73.4 t -77.0 -40.18 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 20.0 110.822 176.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.9 t -62.46 -36.27 81.93 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.781 1.232 . . . . 20.0 112.628 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -76.04 -6.43 51.03 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 20.0 113.341 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.37 25.4 21.42 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.799 -1.001 . . . . 20.0 113.977 171.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -111.13 174.62 5.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.542 1.137 . . . . 20.0 111.594 -177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.79 178.03 16.57 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.033 1.302 . . . . 20.0 113.063 -171.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.9 m -123.51 69.33 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.242 1.417 . . . . 20.0 109.96 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mp -71.82 155.47 92.12 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 124.715 1.206 . . . . 20.0 109.29 171.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -72.01 162.01 43.1 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.162 2.575 . . . . 20.0 110.632 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -65.08 -24.38 67.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.209 0.604 . . . . 20.0 112.14 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -63.11 -39.43 94.68 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.689 1.196 . . . . 20.0 112.016 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -96.86 -47.8 5.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.412 1.085 . . . . 20.0 111.768 -176.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.13 118.12 36.42 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.36 1.464 . . . . 20.0 110.771 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -70.06 158.0 57.97 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.736 2.291 . . . . 20.0 110.355 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -77.84 -9.95 59.31 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.296 1.039 . . . . 20.0 112.708 -167.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.88 -37.71 39.5 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.306 2.242 . . . . 20.0 112.014 172.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.21 -5.05 55.46 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.413 1.485 . . . . 20.0 113.85 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -74.71 100.86 4.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.877 0.871 . . . . 20.0 111.523 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.6 mt -70.88 175.46 5.05 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.594 1.958 . . . . 20.0 112.605 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.4 p -99.75 -6.45 27.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.481 1.112 . . . . 20.0 113.56 177.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -72.34 172.83 9.64 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.328 1.051 . . . . 20.0 111.91 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.88 170.66 22.38 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.075 1.322 . . . . 20.0 111.684 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.54 12.41 3.39 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.176 1.369 . . . . 20.0 113.881 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 89.8 m -108.47 176.28 5.17 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 125.473 1.509 . . . . 20.0 111.856 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.1 m -110.31 -4.0 15.9 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.768 1.227 . . . . 20.0 111.912 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 p -137.16 -72.19 0.43 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.069 1.748 . . . . 20.0 109.634 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -160.12 143.24 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 124.681 1.193 . . . . 20.0 110.23 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.4 m -73.57 129.29 37.66 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 124.573 1.149 . . . . 20.0 110.245 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.3 t -131.11 113.55 14.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.434 1.094 . . . . 20.0 110.901 -174.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -63.52 108.24 1.32 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.992 2.117 . . . . 20.0 110.921 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.2 mt -83.04 -18.97 37.84 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.77 1.228 . . . . 20.0 113.272 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.5 p -78.75 -12.1 60.01 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.634 0.976 . . . . 20.0 113.634 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 C-N-CA 126.053 1.741 . . . . 20.0 112.813 171.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 tttm . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 114.459 1.281 . . . . 20.0 114.459 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.33 1.9 47.62 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.293 1.901 . . . . 20.0 112.916 -171.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.29 169.76 39.5 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 125.708 1.623 . . . . 20.0 114.201 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -153.54 -179.4 7.74 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.077 1.14 . . . . 20.0 114.077 -169.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.0 m -113.1 82.26 1.63 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.917 2.087 . . . . 20.0 109.981 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.8 165.88 29.94 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 125.204 1.402 . . . . 20.0 111.438 173.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -67.66 150.98 79.73 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.833 3.022 . . . . 20.0 112.807 -176.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.8 mt -63.96 -19.25 65.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.81 1.244 . . . . 20.0 112.409 171.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.34 -24.2 65.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.564 1.545 . . . . 20.0 111.928 174.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -84.71 128.35 34.56 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.282 1.033 . . . . 20.0 110.243 175.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -67.87 107.45 2.64 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.715 1.606 . . . . 20.0 111.276 -175.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.1 t -156.93 -170.26 3.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.273 1.829 . . . . 20.0 109.727 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -120.15 174.81 6.26 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.473 1.909 . . . . 20.0 109.995 175.3 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -136.27 161.38 35.92 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.505 1.522 . . . . 20.0 111.742 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -137.18 22.47 3.01 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.994 1.718 . . . . 20.0 114.439 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . 0.254 23.1 pt20 53.92 21.45 2.83 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 130.366 3.466 . . . . 20.0 116.912 166.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.75 -87.1 0.64 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.568 1.547 . . . . 20.0 109.977 -170.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -75.45 -27.05 58.76 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.577 0.626 . . . . 20.0 110.928 174.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.6 p -71.42 11.93 0.4 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.73 2.012 . . . . 20.0 113.877 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.04 -9.81 8.68 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.909 1.684 . . . . 20.0 112.775 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 t -86.33 -46.85 9.9 Favored 'General case' 0 C--N 1.345 0.395 0 C-N-CA 124.399 1.08 . . . . 20.0 113.122 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 5.0 m -66.54 -8.7 28.48 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.596 1.559 . . . . 20.0 115.083 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.27 164.76 33.17 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.755 1.645 . . . . 20.0 112.778 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -48.34 117.7 2.09 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.273 1.429 . . . . 20.0 112.087 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.07 8.4 11.66 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-O 118.248 -1.307 . . . . 20.0 113.009 -171.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.5 pm0 -105.36 153.49 21.58 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.467 1.634 . . . . 20.0 112.622 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 166.52 33.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.955 2.102 . . . . 20.0 109.486 162.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.6 t -128.09 133.69 49.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.072 0.949 . . . . 20.0 111.045 -175.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 82.6 m -133.81 77.89 1.74 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.331 1.452 . . . . 20.0 109.638 -168.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.462 0.167 0 C-N-CA 123.901 0.881 . . . . 20.0 108.81 -172.663 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 119.505 -0.283 . . . . 20.0 111.472 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.34 -56.33 23.51 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.964 1.306 . . . . 20.0 111.205 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.1 t -72.36 -28.25 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 125.643 1.577 . . . . 20.0 111.006 -178.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.3 t -66.72 -38.31 86.45 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.308 1.043 . . . . 20.0 111.685 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -75.05 -10.54 59.57 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.566 1.146 . . . . 20.0 112.886 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.71 1.16 62.01 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.841 1.21 . . . . 20.0 114.817 172.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -73.01 175.26 6.82 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.423 1.112 . . . . 20.0 111.561 175.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -106.32 166.91 13.97 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 124.873 1.225 . . . . 20.0 112.226 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -118.71 69.17 0.8 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.245 1.418 . . . . 20.0 109.202 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.18 156.18 90.9 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.99 1.316 . . . . 20.0 109.69 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.48 161.77 44.6 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.658 2.239 . . . . 20.0 111.215 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -63.54 -24.61 67.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.031 0.932 . . . . 20.0 112.148 177.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 p -65.99 -46.56 77.55 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.836 1.254 . . . . 20.0 111.982 173.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -80.77 -52.58 7.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.553 1.141 . . . . 20.0 111.558 -176.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.4 t -67.94 120.35 73.35 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.903 1.281 . . . . 20.0 110.657 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -69.31 161.49 45.66 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.316 2.677 . . . . 20.0 110.845 175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.71 -21.08 62.6 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.008 1.323 . . . . 20.0 112.696 -166.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.22 -39.46 59.98 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.877 2.471 . . . . 20.0 112.113 176.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.08 -5.21 55.48 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.083 1.353 . . . . 20.0 113.415 -177.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.98 102.39 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 124.291 1.036 . . . . 20.0 110.646 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.41 170.19 14.77 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.53 1.132 . . . . 20.0 111.983 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -91.91 -9.69 42.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.286 1.434 . . . . 20.0 112.698 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -71.41 159.88 33.75 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.693 1.197 . . . . 20.0 112.358 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -112.8 -179.5 19.49 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.7 1.619 . . . . 20.0 112.802 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.43 -5.75 41.4 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.382 1.467 . . . . 20.0 114.071 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.5 m -82.44 178.32 8.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.925 1.29 . . . . 20.0 112.524 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -114.57 -2.35 13.15 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.539 1.536 . . . . 20.0 111.649 175.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.8 p -138.64 -74.25 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.225 1.81 . . . . 20.0 109.841 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -166.74 143.61 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 126.526 1.93 . . . . 20.0 108.967 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.05 145.08 40.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.48 0.712 . . . . 20.0 110.265 173.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.09 118.66 14.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.854 0.861 . . . . 20.0 110.304 -176.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 93.13 0.33 Allowed 'General case' 0 C--N 1.346 0.417 0 C-N-CA 123.793 0.837 . . . . 20.0 111.665 178.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.31 -28.22 67.81 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.494 0.717 . . . . 20.0 111.65 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 t -78.38 -11.74 59.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.496 1.518 . . . . 20.0 113.226 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.7 mttp . . . . . 0 N--CA 1.467 0.418 0 C-N-CA 124.806 1.242 . . . . 20.0 113.465 -176.327 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 114.736 1.384 . . . . 20.0 114.736 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 6.96 66.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.029 1.776 . . . . 20.0 113.712 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.43 -161.05 4.36 Favored Glycine 0 C--N 1.343 0.947 0 C-N-CA 126.618 2.056 . . . . 20.0 114.021 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -130.53 171.45 13.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 122.95 0.5 . . . . 20.0 112.272 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.2 t -98.57 107.58 20.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.96 0.904 . . . . 20.0 110.421 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -137.21 156.51 75.38 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.878 2.471 . . . . 20.0 109.518 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.69 164.69 30.29 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.593 2.862 . . . . 20.0 113.494 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 69' ' ' LYS . 91.4 mt -61.55 -21.14 64.01 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.682 1.593 . . . . 20.0 112.702 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -98.8 9.9 42.41 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.843 1.657 . . . . 20.0 113.337 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.4 tpt85 -74.78 33.13 0.09 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.442 1.897 . . . . 20.0 112.985 175.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.28 -8.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 129.568 3.147 . . . . 20.0 114.459 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 59.3 m -74.29 148.84 41.07 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.554 1.542 . . . . 20.0 111.274 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -150.26 116.25 5.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.352 1.461 . . . . 20.0 110.493 173.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 5.3 tp10 -160.26 -173.97 4.29 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.328 1.451 . . . . 20.0 109.97 178.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.448 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.0 pp -56.94 158.47 4.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.252 1.821 . . . . 20.0 113.061 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -121.17 -0.52 9.93 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.931 2.092 . . . . 20.0 113.692 174.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.92 -9.56 39.48 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.748 1.619 . . . . 20.0 114.623 176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -135.07 -42.66 0.73 Allowed 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.208 1.403 . . . . 20.0 111.44 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.2 p -63.43 -16.45 60.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.356 1.462 . . . . 20.0 113.907 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.81 -2.3 0.53 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.011 2.124 . . . . 20.0 114.009 171.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m -56.97 -39.73 75.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.2 1.8 . . . . 20.0 112.748 172.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.5 t -76.46 -15.76 59.83 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 119.058 0.845 . . . . 20.0 112.684 173.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.45 -175.54 21.88 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 126.099 1.809 . . . . 20.0 111.365 -171.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -65.47 99.86 0.45 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.567 1.547 . . . . 20.0 109.642 175.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.07 -24.85 0.61 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.182 1.372 . . . . 20.0 112.832 -175.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -105.08 138.51 41.17 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.993 1.397 . . . . 20.0 111.672 -175.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD2' ' HA ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -133.48 138.64 46.25 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.838 2.455 . . . . 20.0 110.746 175.682 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.0 t -55.6 110.76 0.76 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.544 1.138 . . . . 20.0 111.428 -177.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.9 t -138.92 72.38 1.4 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 123.415 0.686 . . . . 20.0 112.348 -169.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.338 0.1 0 C-N-CA 124.749 1.22 . . . . 20.0 109.42 -178.971 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 110.443 -0.206 . . . . 20.0 110.443 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -100.44 -45.22 5.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.149 0.979 . . . . 20.0 110.802 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 79.8 m -65.25 -26.2 68.0 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.631 1.173 . . . . 20.0 112.996 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.1 t -65.02 -52.77 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.057 1.343 . . . . 20.0 109.905 167.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 t -63.28 -30.84 71.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.866 1.266 . . . . 20.0 112.94 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.66 -31.22 21.19 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.782 1.233 . . . . 20.0 111.942 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.25 58.88 1.19 Allowed Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.202 1.382 . . . . 20.0 113.324 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -127.44 -178.76 4.58 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.001 2.12 . . . . 20.0 111.25 174.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.91 178.83 32.4 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.27 1.414 . . . . 20.0 113.037 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.5 m -128.37 30.3 5.2 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.545 1.938 . . . . 20.0 112.239 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.6 148.11 67.67 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.111 0.965 . . . . 20.0 110.825 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.93 164.08 36.8 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.136 2.557 . . . . 20.0 111.841 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -60.07 -29.6 68.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.059 1.743 . . . . 20.0 112.221 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.0 m -72.71 -35.19 67.53 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.179 0.992 . . . . 20.0 112.602 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -81.21 -65.65 0.99 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.14 0.976 . . . . 20.0 110.405 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 m -70.51 154.3 94.5 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 123.697 0.799 . . . . 20.0 111.359 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.24 173.39 14.59 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.694 2.929 . . . . 20.0 111.719 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.42 -18.56 61.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.065 1.346 . . . . 20.0 113.037 -174.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -90.7 -36.54 14.27 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.958 2.103 . . . . 20.0 112.877 -175.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.45 -9.74 57.27 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.505 1.522 . . . . 20.0 113.658 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.12 101.46 1.44 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.661 1.585 . . . . 20.0 110.702 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -72.22 164.02 26.96 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.672 1.189 . . . . 20.0 111.106 175.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.9 m -94.39 -11.35 30.08 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.084 1.353 . . . . 20.0 113.172 -175.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.436 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 24.1 m-85 -64.88 168.58 6.15 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.67 1.988 . . . . 20.0 112.278 177.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -123.89 -178.6 15.46 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.889 1.233 . . . . 20.0 113.935 -175.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.93 -16.47 54.3 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.833 2.159 . . . . 20.0 114.444 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.1 m -73.07 -178.63 2.92 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.778 1.231 . . . . 20.0 112.65 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -94.7 -18.0 21.71 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.676 0.79 . . . . 20.0 111.958 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 p -142.1 -73.02 0.31 Allowed 'General case' 0 C--N 1.34 0.177 0 C-N-CA 125.455 1.502 . . . . 20.0 109.454 -173.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.51 148.64 11.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.574 1.549 . . . . 20.0 108.208 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.9 m -84.62 145.68 27.89 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.735 0.414 . . . . 20.0 110.217 173.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 45.2 t -134.49 120.87 20.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.557 1.143 . . . . 20.0 110.124 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.34 88.43 0.64 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.69 1.196 . . . . 20.0 112.747 -178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.5 mt -66.1 -22.14 66.39 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.555 1.142 . . . . 20.0 112.571 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.1 m -65.68 -22.08 66.6 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 125.812 1.645 . . . . 20.0 112.6 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -127.35 4.81 6.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.595 1.558 . . . . 20.0 112.569 -170.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.54 -41.91 14.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.061 1.744 . . . . 20.0 111.071 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.6 p -98.57 -80.55 0.46 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.563 1.545 . . . . 20.0 110.899 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.71 -127.26 1.67 Allowed Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.5 1.048 . . . . 20.0 111.124 -175.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.05 83.66 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.957 1.303 . . . . 20.0 111.629 -178.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -62.42 -24.62 67.51 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.145 1.778 . . . . 20.0 113.502 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.75 -35.47 67.86 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.313 1.435 . . . . 20.0 114.319 -172.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -121.42 -20.43 6.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.801 1.64 . . . . 20.0 112.692 171.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 141.77 -38.71 1.47 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 124.338 0.971 . . . . 20.0 112.365 167.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 170.64 46.66 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.333 0.968 . . . . 20.0 113.797 171.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -153.59 129.09 9.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.925 1.29 . . . . 20.0 110.369 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.6 m -87.99 128.75 35.39 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.362 1.065 . . . . 20.0 109.121 162.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.35 159.15 73.0 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 126.016 1.727 . . . . 20.0 109.124 168.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.15 160.3 38.94 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.841 3.027 . . . . 20.0 112.723 -170.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.32 -20.64 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.243 1.017 . . . . 20.0 112.362 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -28.29 65.52 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.917 1.687 . . . . 20.0 111.772 175.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.9 ttm-85 -99.45 111.64 23.96 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.448 1.099 . . . . 20.0 110.04 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -73.98 116.31 14.46 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.331 1.453 . . . . 20.0 109.346 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 45.8 t -144.59 -91.54 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.666 1.187 . . . . 20.0 110.276 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.431 ' HE3' ' HA ' ' A' ' 71' ' ' CYS . 22.2 ttpp -154.06 158.24 40.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.229 1.812 . . . . 20.0 109.646 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -131.68 133.08 44.49 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.841 1.256 . . . . 20.0 110.278 -176.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 tp -159.18 103.59 1.65 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.013 1.325 . . . . 20.0 110.144 -171.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -66.27 -6.69 14.73 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.96 1.704 . . . . 20.0 115.061 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.95 78.99 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.324 1.05 . . . . 20.0 113.473 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -137.24 -49.42 0.61 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.282 1.033 . . . . 20.0 111.337 -169.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.5 p -67.82 -10.23 51.12 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.106 1.151 . . . . 20.0 114.106 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.44 -20.57 46.04 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.617 1.339 . . . . 20.0 114.617 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 90.7 p -125.13 34.59 4.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.836 1.254 . . . . 20.0 112.135 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.4 -13.8 59.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.633 0.975 . . . . 20.0 113.633 174.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.15 -103.23 0.89 Allowed Glycine 0 C--N 1.343 0.958 0 C-N-CA 125.349 1.452 . . . . 20.0 110.573 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -70.31 93.72 0.88 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.244 1.417 . . . . 20.0 109.474 173.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.88 60.18 1.09 Allowed Glycine 0 C--N 1.337 0.617 0 C-N-CA 124.502 1.049 . . . . 20.0 112.614 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -75.1 36.4 0.11 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.935 2.494 . . . . 20.0 114.858 177.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -119.75 99.46 6.66 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.664 1.986 . . . . 20.0 111.703 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.31 125.75 28.53 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.443 1.497 . . . . 20.0 110.962 173.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.431 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 80.5 m -127.5 135.66 50.68 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.828 1.651 . . . . 20.0 109.867 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.6 p -150.86 150.51 13.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.886 1.274 . . . . 20.0 108.993 175.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -135.51 -176.95 4.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.315 1.846 . . . . 20.0 110.514 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.67 -45.85 90.91 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.722 1.209 . . . . 20.0 110.979 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 72.1 m80 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 116.654 -1.641 . . . . 20.0 111.911 173.9 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 109.472 -0.566 . . . . 20.0 109.472 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -63.76 -31.76 73.04 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.627 1.171 . . . . 20.0 112.58 -175.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.0 m -53.58 -59.86 4.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.9 1.68 . . . . 20.0 110.946 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.8 t -64.3 -34.26 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 125.699 1.6 . . . . 20.0 111.387 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -68.78 -16.96 63.95 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.901 1.28 . . . . 20.0 112.925 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -102.29 -7.71 21.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.121 1.768 . . . . 20.0 112.139 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.7 0.08 52.61 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.335 1.922 . . . . 20.0 114.133 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -86.32 177.09 7.58 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.042 1.737 . . . . 20.0 111.131 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.97 -176.54 16.42 Favored Glycine 0 C--N 1.341 0.81 0 C-N-CA 124.851 1.215 . . . . 20.0 113.229 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.31 76.57 1.73 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.795 1.638 . . . . 20.0 109.304 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.09 162.02 75.81 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 125.103 1.361 . . . . 20.0 109.627 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.23 161.76 44.82 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.48 2.12 . . . . 20.0 110.457 170.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.73 -26.92 68.93 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.964 0.906 . . . . 20.0 111.469 171.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.4 m -69.73 -16.31 63.3 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.045 1.338 . . . . 20.0 113.582 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -122.34 -41.83 2.39 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.828 1.251 . . . . 20.0 111.825 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.6 t -67.63 119.46 66.11 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 123.878 0.871 . . . . 20.0 109.883 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.91 163.14 38.66 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.175 2.583 . . . . 20.0 111.276 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -72.32 -3.56 24.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.788 1.635 . . . . 20.0 113.268 -170.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -100.27 -36.51 9.25 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.248 2.619 . . . . 20.0 111.846 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.51 -13.6 59.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.167 1.387 . . . . 20.0 113.589 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -67.02 120.87 14.37 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.888 1.275 . . . . 20.0 110.852 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.4 mt -86.81 178.83 6.88 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.855 1.262 . . . . 20.0 110.829 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -102.22 -1.31 31.53 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.242 1.417 . . . . 20.0 112.688 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -68.02 174.9 3.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.968 1.707 . . . . 20.0 113.398 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.24 -176.77 14.57 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.92 1.724 . . . . 20.0 112.812 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.89 -11.79 59.08 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 126.148 1.832 . . . . 20.0 113.422 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 71.2 m -74.0 175.86 7.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.504 1.152 . . . . 20.0 112.78 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.7 m -106.27 -14.72 15.04 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.917 1.287 . . . . 20.0 111.938 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.2 p -138.01 -69.71 0.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.046 1.738 . . . . 20.0 109.985 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -157.12 156.11 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 125.35 1.46 . . . . 20.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -79.47 161.46 26.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.979 0.912 . . . . 20.0 110.338 171.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -151.35 117.56 5.61 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.638 0.775 . . . . 20.0 110.793 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -70.75 98.77 1.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.643 1.577 . . . . 20.0 110.405 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.3 mt -79.59 -16.46 55.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.402 1.081 . . . . 20.0 113.19 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -71.11 -33.19 69.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.37 1.068 . . . . 20.0 111.455 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -100.59 8.69 43.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.117 1.367 . . . . 20.0 112.959 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.6 tp -100.74 -39.54 7.78 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 126.077 1.751 . . . . 20.0 111.493 -178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.1 p -101.58 -97.92 0.27 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.01 1.324 . . . . 20.0 111.138 -175.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.34 -99.44 0.18 Allowed Glycine 0 C--N 1.343 0.96 0 CA-C-N 118.997 0.817 . . . . 20.0 111.978 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -69.21 -23.21 63.87 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.308 1.043 . . . . 20.0 112.352 176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 34.2 tttp 63.9 13.45 7.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.685 1.994 . . . . 20.0 113.881 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.97 -153.42 30.23 Favored Glycine 0 CA--C 1.533 1.219 0 C-N-CA 126.108 1.813 . . . . 20.0 112.179 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -62.99 -25.36 68.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 20.0 112.576 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 166.77 -35.2 0.23 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.617 1.103 . . . . 20.0 112.944 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.13 166.84 15.09 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 125.248 1.404 . . . . 20.0 113.99 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -151.03 167.49 27.5 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.767 1.227 . . . . 20.0 112.68 -172.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.8 m -87.23 66.14 9.1 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.421 1.488 . . . . 20.0 110.848 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.75 158.45 87.77 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.252 1.021 . . . . 20.0 111.177 172.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.86 156.22 66.78 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 124.066 3.177 . . . . 20.0 112.092 -173.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.16 -20.63 65.58 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 20.0 113.083 173.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.47 -15.16 62.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.714 1.606 . . . . 20.0 112.872 175.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.405 HH11 ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -80.9 139.8 35.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 20.0 110.201 178.361 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -80.5 101.83 9.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.796 -0.816 . . . . 20.0 108.796 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.416 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -156.9 175.49 14.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.07 1.348 . . . . 20.0 109.995 179.55 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -76.91 159.12 30.26 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.697 0.799 . . . . 20.0 109.715 170.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -125.18 144.15 50.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.603 1.161 . . . . 20.0 110.117 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.6 170.71 14.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.403 2.281 . . . . 20.0 110.19 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -104.02 -4.07 23.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.059 1.744 . . . . 20.0 110.812 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.37 -82.46 0.08 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.101 1.76 . . . . 20.0 111.564 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.2 -32.68 61.28 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.135 1.374 . . . . 20.0 112.542 -173.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.94 -25.04 67.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.511 1.124 . . . . 20.0 111.934 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.51 -19.82 63.72 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.355 1.062 . . . . 20.0 113.663 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.8 m -66.53 -56.19 11.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.992 1.317 . . . . 20.0 110.269 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 83.1 m -70.83 -21.79 62.4 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.859 0.864 . . . . 20.0 112.01 173.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.47 -94.06 1.67 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.945 2.212 . . . . 20.0 112.736 172.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -138.48 164.04 30.4 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.782 1.633 . . . . 20.0 111.754 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.57 -16.82 59.93 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.926 1.251 . . . . 20.0 112.783 -170.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -122.08 178.5 4.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.988 1.715 . . . . 20.0 112.417 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -150.32 156.21 41.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.579 2.751 . . . . 20.0 108.697 169.017 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 37.4 t -73.97 133.04 42.98 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.597 -0.52 . . . . 20.0 109.597 172.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.6 t -156.06 163.32 39.82 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.666 1.187 . . . . 20.0 110.351 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p -154.17 164.18 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.906 1.283 . . . . 20.0 110.588 176.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -130.77 -173.72 3.16 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.87 1.668 . . . . 20.0 112.497 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 21.3 tp -115.89 151.88 34.48 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.881 2.072 . . . . 20.0 109.529 176.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 73.8 t60 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.387 2.275 . . . . 20.0 113.408 177.499 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 110.114 -0.328 . . . . 20.0 110.114 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -72.16 -43.83 64.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.963 0.905 . . . . 20.0 112.036 -174.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.75 -36.7 83.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.079 0.952 . . . . 20.0 111.983 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.3 t -68.44 -43.3 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.894 1.278 . . . . 20.0 110.513 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.0 m -62.57 -42.82 99.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.175 0.99 . . . . 20.0 111.967 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -66.13 -22.08 66.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.775 1.23 . . . . 20.0 112.663 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.0 3.34 55.87 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.513 1.53 . . . . 20.0 114.597 176.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.91 -179.53 3.23 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.425 1.49 . . . . 20.0 111.684 174.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.6 171.91 13.98 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.955 1.264 . . . . 20.0 113.382 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.08 63.38 0.79 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.715 1.606 . . . . 20.0 110.071 176.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.03 156.21 92.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 124.522 1.129 . . . . 20.0 109.874 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.21 160.67 48.75 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.663 2.242 . . . . 20.0 110.6 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -63.59 -23.15 67.27 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.078 0.951 . . . . 20.0 111.385 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.3 t -59.87 -57.02 14.67 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.016 1.327 . . . . 20.0 111.039 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -85.58 -45.64 11.56 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.589 0.756 . . . . 20.0 111.436 -169.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -65.07 124.27 86.3 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.165 0.986 . . . . 20.0 110.416 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -69.09 161.58 45.26 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.915 2.41 . . . . 20.0 110.776 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -77.75 -0.46 27.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.934 1.294 . . . . 20.0 113.65 -169.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -102.79 -35.23 8.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.25 2.22 . . . . 20.0 112.521 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.95 -12.77 61.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.477 1.111 . . . . 20.0 113.638 175.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -66.99 121.21 15.05 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 124.773 1.229 . . . . 20.0 110.508 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.3 mt -84.26 169.74 14.41 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.803 1.241 . . . . 20.0 112.569 -176.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.6 p -84.36 -16.54 42.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 20.0 112.627 175.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -73.91 172.58 11.33 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.703 2.001 . . . . 20.0 111.809 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.78 -179.15 15.95 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.734 1.635 . . . . 20.0 111.775 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.23 25.18 1.69 Allowed Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.378 0.99 . . . . 20.0 113.845 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.6 m -128.29 -179.77 5.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.671 1.588 . . . . 20.0 111.8 -173.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.6 m -104.5 -11.78 16.84 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.749 0.819 . . . . 20.0 112.215 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.3 p -138.4 -66.81 0.48 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.922 1.289 . . . . 20.0 109.807 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.0 155.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.251 1.82 . . . . 20.0 108.934 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.8 m -82.65 160.1 22.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.035 0.534 . . . . 20.0 110.701 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 t -147.16 119.08 8.13 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.368 0.667 . . . . 20.0 110.051 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -69.75 99.32 1.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.237 1.415 . . . . 20.0 110.262 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 mt -77.23 -13.55 59.92 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.249 1.02 . . . . 20.0 112.663 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.7 t -85.02 -16.11 41.87 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.647 1.579 . . . . 20.0 113.218 -177.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -137.02 17.37 3.01 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.88 1.272 . . . . 20.0 113.212 175.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -40.78 91.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.653 1.181 . . . . 20.0 111.52 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.2 t -135.55 167.58 20.82 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.103 1.361 . . . . 20.0 112.111 -171.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -164.38 -153.39 7.4 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 126.282 1.896 . . . . 20.0 111.486 -174.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.4 t -55.53 -61.42 2.36 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.085 1.354 . . . . 20.0 110.489 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -66.38 -13.33 60.5 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.043 1.737 . . . . 20.0 114.008 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.4 -5.27 81.81 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 124.599 1.095 . . . . 20.0 114.288 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -124.9 -17.09 5.93 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.406 1.882 . . . . 20.0 113.218 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.54 35.39 0.65 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.196 1.379 . . . . 20.0 111.912 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.16 157.47 27.68 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.139 1.352 . . . . 20.0 113.637 -173.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -146.32 155.84 42.92 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.894 1.278 . . . . 20.0 109.822 -175.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 18.8 t -106.55 111.91 24.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.794 1.638 . . . . 20.0 109.135 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -141.48 156.33 66.91 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 127.305 2.242 . . . . 20.0 110.291 -167.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.23 161.25 34.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.226 2.617 . . . . 20.0 113.497 -170.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.07 -18.43 65.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.808 0.843 . . . . 20.0 112.238 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -66.85 -22.39 65.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.066 1.747 . . . . 20.0 112.041 172.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.38 122.95 26.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.56 1.544 . . . . 20.0 109.138 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -69.93 104.06 2.41 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.587 1.155 . . . . 20.0 110.574 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 t -159.82 175.75 12.73 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.388 1.475 . . . . 20.0 110.296 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -78.38 141.38 38.41 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.672 1.189 . . . . 20.0 109.372 171.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.84 133.24 49.16 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.121 1.368 . . . . 20.0 109.172 173.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.22 122.16 23.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.393 1.877 . . . . 20.0 111.041 -170.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -64.43 -15.96 61.55 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.748 1.619 . . . . 20.0 114.129 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.47 63.91 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.268 1.427 . . . . 20.0 113.793 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -139.17 -37.68 0.51 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.672 1.189 . . . . 20.0 112.518 -168.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.8 t -64.42 -29.39 70.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.5 1.12 . . . . 20.0 112.447 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.62 72.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.581 0.752 . . . . 20.0 111.711 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.0 m -79.58 -33.14 41.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.045 1.338 . . . . 20.0 111.972 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.7 m -63.87 -34.02 77.01 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.388 1.075 . . . . 20.0 111.47 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.68 170.84 47.25 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 125.728 1.632 . . . . 20.0 112.796 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 126.24 26.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.648 1.179 . . . . 20.0 111.627 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 114.23 -19.68 17.19 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.689 1.614 . . . . 20.0 113.298 -178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -138.44 177.32 7.97 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.222 1.809 . . . . 20.0 111.98 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -151.31 173.37 14.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.827 2.051 . . . . 20.0 111.492 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.0 t -91.5 147.17 23.21 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.067 0.547 . . . . 20.0 109.779 163.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 49.9 t -144.0 161.17 39.45 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.758 1.223 . . . . 20.0 109.936 172.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.2 t -126.29 156.08 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 126.251 1.821 . . . . 20.0 109.033 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -127.94 -176.13 3.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.68 1.592 . . . . 20.0 112.043 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.6 tp -133.18 169.29 17.09 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.501 1.52 . . . . 20.0 109.467 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 117.016 -1.468 . . . . 20.0 110.935 176.105 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 109.443 -0.577 . . . . 20.0 109.443 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -66.07 -40.73 91.12 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.799 0.839 . . . . 20.0 112.035 -174.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.32 -36.27 81.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.373 1.069 . . . . 20.0 111.97 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 63.0 t -76.71 -41.99 33.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.49 1.516 . . . . 20.0 110.776 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 t -61.59 -44.16 97.53 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.182 1.393 . . . . 20.0 111.976 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -68.25 -12.97 61.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.469 1.508 . . . . 20.0 113.164 176.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.43 1.28 56.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.145 1.355 . . . . 20.0 114.603 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -74.71 175.17 8.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.57 1.185 . . . . 20.0 112.09 -178.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -103.6 175.9 23.77 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.014 1.292 . . . . 20.0 112.399 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -132.77 65.77 1.58 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.599 1.559 . . . . 20.0 109.42 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.94 158.12 87.65 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.135 0.974 . . . . 20.0 110.028 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.34 165.49 30.32 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.183 2.589 . . . . 20.0 111.389 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -60.92 -32.47 71.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.205 0.602 . . . . 20.0 111.374 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -65.66 -45.69 82.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.096 0.958 . . . . 20.0 112.162 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.61 -49.85 10.73 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.024 0.93 . . . . 20.0 111.725 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -67.64 124.94 90.52 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.193 0.997 . . . . 20.0 110.574 -179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.74 160.78 48.17 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.802 2.335 . . . . 20.0 110.25 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -73.09 -18.49 61.3 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.732 0.813 . . . . 20.0 112.735 -170.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.4 -41.17 33.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.98 2.112 . . . . 20.0 112.365 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -9.02 58.2 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.69 1.196 . . . . 20.0 113.488 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -70.5 113.7 7.88 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.518 1.127 . . . . 20.0 110.748 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 37.4 mt -84.88 170.74 12.82 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.187 1.395 . . . . 20.0 111.957 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 98.0 p -82.44 -13.64 56.43 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.337 1.055 . . . . 20.0 113.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -74.76 175.25 8.14 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.804 1.241 . . . . 20.0 112.591 -175.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -137.14 -176.93 14.66 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.35 1.452 . . . . 20.0 112.317 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.46 -4.73 33.04 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.508 1.528 . . . . 20.0 113.332 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.8 m -78.9 176.33 9.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.663 1.185 . . . . 20.0 111.984 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.8 t -111.54 -6.86 14.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.238 1.415 . . . . 20.0 111.579 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.6 p -131.6 -75.42 0.52 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.165 1.786 . . . . 20.0 109.021 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.2 p -165.58 151.89 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 126.852 2.061 . . . . 20.0 108.358 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.6 m -67.8 154.71 40.95 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.388 0.675 . . . . 20.0 111.497 172.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.3 t -151.06 113.69 4.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.589 0.755 . . . . 20.0 110.132 174.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -69.57 102.72 1.9 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.96 0.904 . . . . 20.0 110.165 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 mt -68.7 -22.28 64.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.189 0.996 . . . . 20.0 111.941 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 t -82.9 -7.0 59.7 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.823 1.649 . . . . 20.0 112.884 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -124.64 11.31 8.5 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.243 1.417 . . . . 20.0 112.803 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.76 -40.93 46.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.156 1.382 . . . . 20.0 111.878 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.2 p -122.6 -69.63 0.82 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.685 1.594 . . . . 20.0 111.048 -172.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.3 -148.23 48.82 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.741 1.162 . . . . 20.0 112.592 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.7 m -60.68 -39.22 87.67 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.601 1.16 . . . . 20.0 112.04 171.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt 73.15 -4.11 2.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.679 3.192 . . . . 20.0 114.932 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -99.83 -17.21 26.32 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 118.743 -1.032 . . . . 20.0 114.244 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.6 mmtm -134.98 -36.88 0.81 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.25 1.42 . . . . 20.0 113.434 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.34 31.94 2.48 Favored Glycine 0 CA--C 1.532 1.138 0 CA-C-O 118.847 -0.974 . . . . 20.0 112.538 -170.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.67 179.41 20.17 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.714 1.626 . . . . 20.0 112.21 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -119.88 166.57 13.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.163 1.385 . . . . 20.0 112.323 -171.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 49.2 m -90.84 -43.14 10.23 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.268 1.027 . . . . 20.0 113.758 -173.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.68 171.03 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.217 2.207 . . . . 20.0 114.537 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.85 149.58 66.48 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.261 1.974 . . . . 20.0 110.713 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.58 -24.23 65.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.001 1.32 . . . . 20.0 113.076 177.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -78.11 -8.44 58.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.978 1.711 . . . . 20.0 113.076 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 164.73 26.0 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.587 1.155 . . . . 20.0 110.374 170.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -107.56 104.15 13.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.533 1.533 . . . . 20.0 109.265 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -158.78 167.67 28.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.957 1.703 . . . . 20.0 110.602 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.55 160.45 31.46 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.889 1.275 . . . . 20.0 111.818 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -133.22 114.26 13.61 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 126.247 1.819 . . . . 20.0 109.494 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pp -136.29 103.38 5.28 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.955 1.702 . . . . 20.0 110.235 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -61.26 -12.16 12.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.635 1.974 . . . . 20.0 113.564 -173.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.67 95.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.796 1.638 . . . . 20.0 113.325 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -119.74 -40.39 2.76 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.897 1.279 . . . . 20.0 111.429 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.3 p -70.52 -15.22 62.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.544 1.138 . . . . 20.0 113.911 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.8 18.65 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.534 1.309 . . . . 20.0 114.534 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 59.7 p -112.73 17.86 18.74 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.894 1.678 . . . . 20.0 113.572 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.8 m -67.27 -83.41 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.66 1.184 . . . . 20.0 111.286 174.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.2 -28.84 9.29 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.143 1.354 . . . . 20.0 114.399 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -136.11 35.84 2.8 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.303 1.441 . . . . 20.0 112.805 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -166.69 -45.86 0.02 OUTLIER Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.159 -0.801 . . . . 20.0 113.59 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.55 25.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 129.003 2.921 . . . . 20.0 117.017 -172.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.07 129.42 46.61 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 126.949 2.1 . . . . 20.0 108.749 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.2 t -110.38 127.92 55.32 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.989 0.916 . . . . 20.0 109.279 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.7 t -129.59 120.85 25.97 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.113 1.365 . . . . 20.0 108.855 -174.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.2 t -135.49 110.85 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.974 1.309 . . . . 20.0 108.092 -171.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -80.71 -177.71 6.43 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.936 1.295 . . . . 20.0 111.238 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -136.71 152.62 50.57 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.1 1.36 . . . . 20.0 110.269 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 116.776 -1.583 . . . . 20.0 111.237 175.867 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.345 -0.243 . . . . 20.0 110.345 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -114.96 -43.67 3.09 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 124.429 1.092 . . . . 20.0 111.768 -173.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 33.2 m -63.91 -39.1 93.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.915 -0.565 . . . . 20.0 111.431 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.0 t -66.89 -35.4 74.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.192 0.997 . . . . 20.0 111.132 174.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -65.61 -35.46 80.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.139 0.976 . . . . 20.0 112.106 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.55 -28.06 41.25 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.592 1.157 . . . . 20.0 112.326 176.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.75 -1.32 32.06 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.408 1.48 . . . . 20.0 114.126 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -70.22 176.67 3.73 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.387 1.475 . . . . 20.0 111.588 172.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.96 179.13 20.5 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 125.263 1.411 . . . . 20.0 113.234 -175.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.9 m -132.56 54.43 1.95 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.153 1.781 . . . . 20.0 110.423 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.57 159.92 64.12 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.367 1.467 . . . . 20.0 111.276 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -68.92 158.31 58.42 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.463 2.109 . . . . 20.0 110.931 171.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.13 -24.65 67.77 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.451 1.1 . . . . 20.0 111.589 176.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.7 m -72.62 -19.53 61.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.222 1.409 . . . . 20.0 113.458 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -107.12 -54.34 2.49 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.758 1.223 . . . . 20.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.92 120.55 67.55 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.603 1.161 . . . . 20.0 110.259 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -68.46 165.55 28.68 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.977 2.451 . . . . 20.0 110.735 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -71.16 -14.62 62.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.904 0.882 . . . . 20.0 113.129 -170.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -85.18 -40.7 16.4 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.499 2.32 . . . . 20.0 112.432 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.06 -7.16 52.92 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.634 1.574 . . . . 20.0 113.613 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.57 107.68 5.21 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.458 1.503 . . . . 20.0 110.961 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -72.57 168.32 18.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.004 1.322 . . . . 20.0 112.139 177.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -89.48 -13.94 36.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.43 1.492 . . . . 20.0 112.75 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.43 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 27.6 m-85 -66.25 172.31 4.01 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.103 2.161 . . . . 20.0 111.992 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -138.97 -175.83 14.25 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.683 1.135 . . . . 20.0 113.18 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.4 -11.29 56.74 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.115 1.817 . . . . 20.0 113.632 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.3 m -69.7 175.09 4.45 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.58 1.152 . . . . 20.0 112.782 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.5 p -100.06 -14.52 18.58 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.656 1.583 . . . . 20.0 111.84 -176.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 p -141.6 -72.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.917 2.087 . . . . 20.0 109.156 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -159.05 154.02 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.481 1.512 . . . . 20.0 108.703 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 67.9 m -72.45 161.15 31.19 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.883 0.473 . . . . 20.0 111.711 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.3 120.86 6.92 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.163 0.985 . . . . 20.0 109.988 171.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -70.24 92.84 0.8 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 20.0 111.827 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.8 -37.07 86.38 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.496 1.119 . . . . 20.0 112.182 -174.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.1 t -63.04 -31.61 72.79 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.494 1.118 . . . . 20.0 111.95 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp -101.63 2.62 39.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.429 1.091 . . . . 20.0 113.396 -176.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -52.18 20.39 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.189 1.396 . . . . 20.0 110.934 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.5 p 36.78 82.49 0.02 OUTLIER 'General case' 0 C--N 1.342 0.256 0 C-N-CA 129.133 2.973 . . . . 20.0 113.285 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -73.81 172.1 51.42 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.086 -1.415 . . . . 20.0 112.436 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 74.1 m -108.72 -41.86 4.67 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.435 1.494 . . . . 20.0 111.274 -174.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -59.0 -36.17 74.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.828 2.051 . . . . 20.0 113.616 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -65.65 -73.09 0.64 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.614 1.578 . . . . 20.0 113.027 -171.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -68.86 -24.84 64.4 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.654 1.182 . . . . 20.0 112.008 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 86.0 -26.25 6.24 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.475 1.988 . . . . 20.0 112.907 -172.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.17 -171.3 48.83 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.175 1.369 . . . . 20.0 114.066 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.3 176.58 7.83 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.447 1.499 . . . . 20.0 112.002 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.0 t -108.46 101.48 10.65 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.007 1.323 . . . . 20.0 110.15 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -130.32 154.64 81.52 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 128.352 2.661 . . . . 20.0 110.945 -170.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.83 162.1 41.08 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.159 2.572 . . . . 20.0 113.221 -170.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.416 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 83.8 mt -66.39 -20.9 66.19 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.138 0.575 . . . . 20.0 112.142 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -69.37 -20.06 63.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.814 1.646 . . . . 20.0 112.391 174.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -68.46 144.59 54.61 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.371 1.068 . . . . 20.0 109.286 171.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -90.1 100.82 13.57 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.306 0.642 . . . . 20.0 109.797 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.39 176.73 9.54 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.737 1.615 . . . . 20.0 111.014 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -117.44 109.94 17.38 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.038 1.335 . . . . 20.0 111.138 -171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HA ' ' H ' ' A' ' 70' ' ' CYS . 1.8 pm0 -64.84 173.31 2.34 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.271 2.229 . . . . 20.0 114.507 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.1 mt -147.41 129.87 15.83 Favored 'General case' 0 C--N 1.347 0.462 0 C-N-CA 126.578 1.951 . . . . 20.0 109.847 167.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -64.29 -12.49 42.09 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.505 0.928 . . . . 20.0 113.505 166.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.86 -70.86 0.43 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.408 1.483 . . . . 20.0 110.969 167.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -85.31 -49.63 8.01 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.07 0.948 . . . . 20.0 112.865 -166.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 p -70.17 -7.01 38.41 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.615 1.166 . . . . 20.0 113.398 -174.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.79 -14.3 62.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.31 1.444 . . . . 20.0 113.663 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.9 t -64.8 -54.83 24.95 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.843 1.257 . . . . 20.0 112.584 -175.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.7 m -74.37 -15.44 60.93 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 118.709 -0.663 . . . . 20.0 112.322 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.39 -154.73 35.08 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-N 119.382 0.992 . . . . 20.0 112.925 175.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -60.19 110.34 1.2 Allowed 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.224 1.41 . . . . 20.0 110.602 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 124.59 -0.1 8.59 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.517 1.532 . . . . 20.0 113.325 -175.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -119.96 149.1 42.67 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.567 1.547 . . . . 20.0 111.596 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 17.2 ptpt -141.34 151.23 43.39 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.779 2.031 . . . . 20.0 109.461 165.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.471 ' H ' ' HA ' ' A' ' 56' ' ' GLU . 8.5 t -63.67 132.28 50.61 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.369 -0.604 . . . . 20.0 109.369 172.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.3 t -157.17 115.09 3.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.778 0.831 . . . . 20.0 110.37 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.75 160.02 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.617 1.167 . . . . 20.0 111.029 170.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -126.4 -178.96 4.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.206 1.803 . . . . 20.0 112.342 -174.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.6 133.83 39.19 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.709 1.604 . . . . 20.0 107.83 173.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.2 m170 . . . . . 0 C--O 1.238 0.487 0 C-N-CA 126.846 2.059 . . . . 20.0 112.182 -172.877 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 110.1 -0.333 . . . . 20.0 110.1 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -64.68 -45.84 84.95 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.993 0.917 . . . . 20.0 110.827 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 39.1 m -64.28 -36.63 84.72 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.879 1.272 . . . . 20.0 112.876 -172.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.8 t -65.6 -46.03 90.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.186 1.394 . . . . 20.0 110.815 174.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 -40.87 98.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.736 1.614 . . . . 20.0 112.828 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -69.96 -27.78 65.01 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.823 1.649 . . . . 20.0 112.924 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.15 41.72 2.96 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.586 -1.119 . . . . 20.0 113.61 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -120.86 175.27 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.519 1.528 . . . . 20.0 111.72 176.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 171.51 26.68 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 124.913 1.245 . . . . 20.0 113.678 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.8 m -126.77 39.95 3.82 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.052 1.741 . . . . 20.0 111.318 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.74 153.84 20.44 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 20.0 110.934 175.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.45 155.97 65.47 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.618 2.212 . . . . 20.0 111.358 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.64 -20.25 66.17 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.776 1.231 . . . . 20.0 111.696 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -76.16 -8.69 57.59 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.825 1.65 . . . . 20.0 113.224 173.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -118.21 -66.65 1.06 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.618 1.567 . . . . 20.0 110.542 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.24 147.54 98.84 Favored Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 118.299 0.5 . . . . 20.0 112.04 -174.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.11 167.24 27.86 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.525 2.817 . . . . 20.0 111.147 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.52 9.99 8.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.973 1.709 . . . . 20.0 113.236 -170.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -121.45 -34.78 3.38 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 126.52 1.928 . . . . 20.0 113.193 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.04 -7.81 44.16 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.291 1.436 . . . . 20.0 112.973 173.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.03 108.29 4.52 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.611 1.564 . . . . 20.0 111.614 -175.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.8 mt -72.35 169.82 15.49 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.085 1.754 . . . . 20.0 112.797 -176.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.3 p -86.55 -17.71 33.35 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.152 1.381 . . . . 20.0 112.927 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -71.78 171.92 10.76 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.518 1.927 . . . . 20.0 111.913 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.99 149.71 19.64 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 125.313 1.435 . . . . 20.0 110.313 169.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 156.26 23.42 0.03 OUTLIER Glycine 0 CA--C 1.531 1.056 0 CA-C-O 118.633 -1.093 . . . . 20.0 114.004 -176.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.8 m -135.91 176.88 8.28 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.426 1.49 . . . . 20.0 112.115 -172.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -89.4 -19.59 25.0 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.461 1.104 . . . . 20.0 112.302 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -142.37 -66.39 0.39 Allowed 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.19 1.396 . . . . 20.0 110.747 -168.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.87 141.19 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.926 1.29 . . . . 20.0 109.466 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.4 m -78.64 104.44 9.25 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.625 1.17 . . . . 20.0 109.604 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.9 t -100.56 117.2 34.21 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.226 1.01 . . . . 20.0 110.819 -177.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -66.71 99.68 0.63 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.079 1.752 . . . . 20.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.0 mt -74.49 -18.27 60.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.367 1.067 . . . . 20.0 112.943 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.4 t -72.37 -21.68 61.25 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.268 1.027 . . . . 20.0 112.822 -176.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.07 -2.72 16.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.031 1.732 . . . . 20.0 113.58 175.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.8 tp -89.87 -43.67 10.45 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.799 1.64 . . . . 20.0 111.196 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.1 p -103.3 171.16 7.53 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.612 1.565 . . . . 20.0 111.193 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 86.34 162.38 36.85 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.294 1.426 . . . . 20.0 112.424 -178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 39.0 t -64.35 -49.54 71.28 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.716 1.206 . . . . 20.0 110.722 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -70.48 -13.2 62.02 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.694 1.598 . . . . 20.0 114.008 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -65.51 -77.01 0.28 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 125.954 1.74 . . . . 20.0 111.977 -173.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.0 -25.09 65.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.257 0.623 . . . . 20.0 111.893 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.2 -7.91 32.89 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.662 2.077 . . . . 20.0 113.066 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.74 156.66 6.22 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.618 1.58 . . . . 20.0 112.531 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -92.41 140.19 29.83 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.038 0.935 . . . . 20.0 110.281 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.94 8.67 22.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.851 1.66 . . . . 20.0 113.092 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.72 150.25 1.3 Allowed Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.389 2.676 . . . . 20.0 113.44 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -64.92 159.84 44.17 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 123.196 2.597 . . . . 20.0 112.849 -170.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 71.7 mt -62.49 -20.51 64.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.342 0.657 . . . . 20.0 112.501 170.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -78.45 -17.62 56.08 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.562 1.545 . . . . 20.0 113.24 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 158.01 33.02 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.642 1.177 . . . . 20.0 110.807 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -70.92 -9.28 57.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.807 1.643 . . . . 20.0 114.641 -174.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.9 m -60.07 154.93 18.11 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 125.336 1.454 . . . . 20.0 111.61 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -154.38 118.32 4.7 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.126 1.37 . . . . 20.0 110.687 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 6.8 tp10 -158.75 -168.67 2.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.248 1.419 . . . . 20.0 109.887 174.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.498 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.9 pp -59.7 158.35 10.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.962 1.705 . . . . 20.0 113.146 171.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -114.84 -10.28 12.38 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.694 1.598 . . . . 20.0 113.291 174.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.15 -56.26 24.35 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 124.058 0.943 . . . . 20.0 112.295 -176.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -85.6 -27.56 25.4 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.893 0.877 . . . . 20.0 112.362 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.48 -32.77 74.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.1 0.96 . . . . 20.0 112.668 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.87 -1.76 0.71 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.507 2.323 . . . . 20.0 115.921 -168.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.6 m -58.66 -22.7 57.6 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.87 1.268 . . . . 20.0 113.594 172.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.43 -8.44 58.49 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.758 1.163 . . . . 20.0 113.793 171.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 89.02 -73.77 2.1 Favored Glycine 0 C--N 1.343 0.935 0 C-N-CA 125.433 1.492 . . . . 20.0 112.306 172.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -133.43 151.64 51.83 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.182 1.793 . . . . 20.0 109.098 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.0 42.45 98.23 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 118.344 -1.253 . . . . 20.0 113.772 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.19 157.92 40.45 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.896 1.278 . . . . 20.0 112.239 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 12.9 ptpt -166.12 132.9 2.63 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.55 1.54 . . . . 20.0 110.512 171.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 156.76 36.33 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.788 0.435 . . . . 20.0 111.207 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.5 t -164.99 13.62 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.736 0.814 . . . . 20.0 112.698 -170.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.1 t -60.78 139.22 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.037 1.335 . . . . 20.0 111.103 -169.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -110.35 -176.14 2.91 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.96 1.304 . . . . 20.0 113.347 -169.133 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.0 tp -114.82 -71.75 0.73 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.453 1.501 . . . . 20.0 109.779 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 52.9 t60 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 125.727 1.611 . . . . 20.0 110.022 179.682 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 110.348 -0.241 . . . . 20.0 110.348 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -113.97 -50.72 2.81 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.023 0.929 . . . . 20.0 110.421 175.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.7 t -62.92 -42.75 99.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.588 0.755 . . . . 20.0 112.327 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.33 -39.82 72.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.01 0.924 . . . . 20.0 110.796 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 t -63.04 -34.05 76.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.822 1.249 . . . . 20.0 112.899 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -74.39 -19.14 60.53 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.795 1.638 . . . . 20.0 112.706 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.37 14.59 35.04 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.945 1.26 . . . . 20.0 114.538 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -75.4 175.04 8.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.765 1.283 . . . . 20.0 112.231 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.5 1.95 13.97 Favored Glycine 0 C--N 1.343 0.962 0 N-CA-C 117.481 1.752 . . . . 20.0 117.481 -160.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m 34.34 61.92 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.266 2.627 . . . . 20.0 113.69 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.5 157.05 87.13 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.296 0.638 . . . . 20.0 109.939 173.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.04 165.39 32.74 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.985 2.457 . . . . 20.0 111.156 174.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -59.87 -38.95 83.66 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.498 0.719 . . . . 20.0 110.664 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 88.9 p -67.38 -10.05 47.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.009 1.724 . . . . 20.0 115.056 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -122.24 -45.05 2.24 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 124.753 1.221 . . . . 20.0 111.001 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.2 t -65.14 119.44 58.89 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.926 1.29 . . . . 20.0 110.331 175.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.15 155.09 72.19 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.357 2.038 . . . . 20.0 110.201 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -69.37 -19.68 63.83 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.215 1.006 . . . . 20.0 112.641 -167.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -74.97 -39.12 61.46 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.76 2.424 . . . . 20.0 112.675 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.47 -9.66 59.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.508 1.123 . . . . 20.0 113.459 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -69.72 117.53 11.43 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 124.007 0.923 . . . . 20.0 110.528 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 mt -88.06 176.38 7.33 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.519 1.528 . . . . 20.0 111.46 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.3 p -105.45 -6.75 19.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.335 1.454 . . . . 20.0 114.004 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.97 172.54 7.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.712 1.205 . . . . 20.0 111.855 175.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.27 177.39 17.2 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.877 1.227 . . . . 20.0 112.771 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.14 -4.1 31.61 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.767 1.651 . . . . 20.0 114.397 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.3 m -77.4 179.85 6.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.233 1.413 . . . . 20.0 112.468 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.7 m -103.16 -11.95 17.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.4 1.08 . . . . 20.0 112.233 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 p -138.32 -71.98 0.41 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.055 1.742 . . . . 20.0 109.654 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -158.36 153.39 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 126.196 1.798 . . . . 20.0 108.724 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 60.9 m -74.26 155.04 38.68 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.519 0.728 . . . . 20.0 111.033 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.9 t -149.32 114.2 5.39 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.394 0.678 . . . . 20.0 110.526 176.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.27 108.58 4.25 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.496 1.118 . . . . 20.0 110.915 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.63 -27.4 58.41 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.763 0.825 . . . . 20.0 113.088 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -73.95 -11.79 60.45 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.084 1.142 . . . . 20.0 114.084 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -124.95 20.44 8.33 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.075 2.15 . . . . 20.0 111.355 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tt -128.36 -45.11 1.37 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.679 1.992 . . . . 20.0 109.387 -177.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.4 p -124.62 171.43 10.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.439 1.896 . . . . 20.0 110.935 177.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.98 -103.28 0.26 Allowed Glycine 0 C--N 1.341 0.837 0 C-N-CA 125.396 1.474 . . . . 20.0 110.246 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 t -87.18 -64.88 1.08 Allowed 'General case' 0 C--N 1.343 0.305 0 CA-C-N 117.799 0.8 . . . . 20.0 110.565 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -139.26 -32.76 0.65 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.657 0.984 . . . . 20.0 113.657 -171.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.83 -67.68 0.08 OUTLIER Glycine 0 C--N 1.343 0.932 0 CA-C-N 119.363 0.983 . . . . 20.0 112.549 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp -68.74 -26.31 65.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.281 1.032 . . . . 20.0 112.823 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.61 -43.04 1.15 Allowed Glycine 0 C--N 1.339 0.702 0 C-N-CA 125.262 1.41 . . . . 20.0 111.146 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.37 167.58 43.78 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.497 1.523 . . . . 20.0 112.459 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.18 157.85 44.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.503 1.921 . . . . 20.0 110.819 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -82.06 109.36 16.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.152 0.981 . . . . 20.0 109.394 173.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -127.1 155.01 76.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.236 2.214 . . . . 20.0 109.971 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.45 164.78 27.25 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.981 3.121 . . . . 20.0 113.428 -168.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 48.6 mt -59.97 -28.85 68.01 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.518 0.727 . . . . 20.0 111.588 168.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.21 -18.51 65.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.696 1.598 . . . . 20.0 112.725 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -65.98 -30.47 71.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.621 1.168 . . . . 20.0 112.316 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.88 1.11 0.78 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.646 2.378 . . . . 20.0 115.612 173.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.6 p -65.59 167.76 8.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.805 1.242 . . . . 20.0 111.68 172.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -63.68 134.15 54.87 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.253 1.021 . . . . 20.0 110.018 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.96 172.55 12.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.611 1.165 . . . . 20.0 112.116 175.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 162.54 29.47 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.978 2.111 . . . . 20.0 110.979 172.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -88.02 -2.28 58.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.633 1.573 . . . . 20.0 113.336 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.29 -70.2 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.483 1.513 . . . . 20.0 110.742 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -83.98 -27.19 28.63 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.499 0.926 . . . . 20.0 113.499 -176.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.3 p -66.19 -21.94 66.33 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.14 -11.0 35.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.993 1.317 . . . . 20.0 112.685 173.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.6 t -107.34 -30.57 8.62 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.887 1.675 . . . . 20.0 112.198 171.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 75.0 m -61.61 -27.23 68.51 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.368 0.986 . . . . 20.0 112.516 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.5 166.77 42.81 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.249 1.404 . . . . 20.0 112.712 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -62.94 133.84 55.27 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.789 1.236 . . . . 20.0 111.067 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.27 -2.41 65.5 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.162 1.363 . . . . 20.0 113.353 -172.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -149.96 137.8 20.15 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.921 1.361 . . . . 20.0 111.814 -170.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.58 172.37 12.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.642 1.977 . . . . 20.0 112.146 -174.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.89 137.58 51.76 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 122.009 -0.432 . . . . 20.0 109.976 167.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.6 t -138.27 168.33 19.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.783 1.633 . . . . 20.0 108.576 163.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p -151.94 162.81 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 123.169 0.587 . . . . 20.0 109.966 170.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -123.19 -178.79 4.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.429 1.492 . . . . 20.0 112.14 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 91.6 mt -103.29 154.38 19.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.598 1.159 . . . . 20.0 109.189 169.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 124.867 1.267 . . . . 20.0 111.3 -176.104 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 51.7 m-20 . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 121.345 0.593 . . . . 20.0 109.639 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -67.91 -40.59 83.38 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.713 1.205 . . . . 20.0 111.366 -173.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.4 t -70.65 -37.42 73.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.542 1.137 . . . . 20.0 112.239 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.31 -37.63 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.305 . . . . 20.0 110.709 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.2 t -58.28 -37.55 75.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.875 1.27 . . . . 20.0 112.075 178.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -77.77 -46.28 22.13 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.518 1.127 . . . . 20.0 111.575 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.59 63.63 2.56 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.419 1.009 . . . . 20.0 112.378 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -95.28 -102.26 0.16 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.57 1.548 . . . . 20.0 108.741 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.58 165.58 35.08 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.153 1.359 . . . . 20.0 111.416 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.9 m -125.45 55.96 1.39 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.276 1.43 . . . . 20.0 110.132 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.42 154.74 90.13 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.074 0.95 . . . . 20.0 109.803 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -69.79 160.08 51.02 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.026 2.484 . . . . 20.0 110.408 170.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.9 -37.31 84.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.768 0.827 . . . . 20.0 112.074 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.0 m -68.72 -21.69 64.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.781 1.03 . . . . 20.0 113.781 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -92.06 -51.13 5.34 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.503 1.121 . . . . 20.0 110.571 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.3 t -62.93 118.51 43.05 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 125.517 1.527 . . . . 20.0 110.941 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.01 155.57 69.13 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.382 2.055 . . . . 20.0 110.206 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -74.08 -16.26 61.04 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.627 1.171 . . . . 20.0 112.72 -165.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.55 -39.82 64.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.649 2.38 . . . . 20.0 112.239 170.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.16 -11.18 59.77 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.612 1.165 . . . . 20.0 113.455 -176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -67.54 112.68 4.83 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.806 0.842 . . . . 20.0 110.694 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.6 mt -78.12 175.99 9.62 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.368 1.867 . . . . 20.0 111.153 174.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.7 p -110.81 -0.25 17.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.719 1.608 . . . . 20.0 112.804 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -72.07 171.57 11.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.73 1.212 . . . . 20.0 111.906 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -129.69 141.84 13.02 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.032 1.301 . . . . 20.0 111.275 174.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 150.09 -14.69 1.0 Allowed Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.763 1.173 . . . . 20.0 114.101 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -77.72 -179.55 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.899 1.35 . . . . 20.0 112.371 172.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.1 t -107.02 -9.53 16.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.496 1.518 . . . . 20.0 111.766 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 p -137.54 -69.61 0.45 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 125.425 1.49 . . . . 20.0 110.158 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.2 p -159.26 144.32 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 20.0 109.86 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 92.4 m -72.99 120.33 18.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.537 1.535 . . . . 20.0 110.173 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.0 t -126.33 108.34 11.15 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.544 1.138 . . . . 20.0 110.607 -171.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -65.04 106.09 1.19 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.54 1.936 . . . . 20.0 111.29 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.2 mt -80.67 -18.2 48.77 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.934 0.894 . . . . 20.0 112.913 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -77.51 -10.57 59.56 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.761 1.225 . . . . 20.0 113.398 -175.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -114.98 0.18 13.6 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.05 1.74 . . . . 20.0 112.998 172.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.6 tp -86.74 -48.18 8.48 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.063 1.745 . . . . 20.0 111.065 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.4 p -76.9 170.91 15.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.634 1.574 . . . . 20.0 112.421 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.92 165.26 14.82 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 126.192 1.853 . . . . 20.0 112.272 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.78 -46.7 68.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.646 0.779 . . . . 20.0 110.516 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -84.02 -15.37 47.86 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.189 1.396 . . . . 20.0 113.117 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.72 -52.31 51.56 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 124.816 1.198 . . . . 20.0 111.561 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -88.99 -21.61 23.43 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.142 1.377 . . . . 20.0 112.5 170.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.6 -24.54 16.8 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.617 1.58 . . . . 20.0 114.094 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.53 -162.66 37.12 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.708 1.147 . . . . 20.0 114.275 173.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -120.99 141.35 50.81 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.121 1.768 . . . . 20.0 109.208 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.9 t -89.05 17.08 6.14 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.928 1.291 . . . . 20.0 113.153 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -43.9 153.02 0.43 Allowed Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 128.92 2.888 . . . . 20.0 114.378 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.85 161.87 44.28 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.618 2.878 . . . . 20.0 112.474 -177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.8 mt -63.62 -18.96 64.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.846 1.258 . . . . 20.0 112.272 172.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -69.45 -25.65 64.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.356 1.463 . . . . 20.0 112.577 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -69.95 160.59 31.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.183 0.993 . . . . 20.0 111.238 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -74.33 97.77 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.381 1.072 . . . . 20.0 110.896 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 98.7 m -153.77 154.84 34.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.782 2.433 . . . . 20.0 109.07 174.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -154.99 92.21 1.43 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.076 1.35 . . . . 20.0 110.394 175.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.483 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.5 tp10 -153.94 -174.7 5.06 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.191 0.996 . . . . 20.0 110.897 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.483 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.5 pp -57.07 158.46 5.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.965 1.706 . . . . 20.0 113.826 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -118.56 -9.11 10.34 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.751 2.021 . . . . 20.0 112.654 175.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -20.0 65.0 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.053 1.341 . . . . 20.0 114.069 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -124.67 -17.92 5.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.344 1.458 . . . . 20.0 111.843 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.5 t -79.29 -20.94 46.76 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.978 1.311 . . . . 20.0 113.498 177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -0.46 5.72 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.239 1.415 . . . . 20.0 114.449 -174.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.6 t -56.64 -45.01 81.85 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.75 1.22 . . . . 20.0 111.602 166.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -69.99 -6.41 33.12 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.485 1.114 . . . . 20.0 113.461 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.21 -166.62 14.57 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.714 1.626 . . . . 20.0 112.389 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.03 46.42 0.39 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.416 1.886 . . . . 20.0 110.537 168.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -150.33 3.99 0.57 Allowed Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.46 1.981 . . . . 20.0 113.329 -173.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -142.61 152.98 43.07 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.675 1.738 . . . . 20.0 110.817 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -132.49 147.98 52.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.582 2.353 . . . . 20.0 108.114 165.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.2 t -60.8 142.74 55.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.848 0.356 . . . . 20.0 111.074 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.9 t -158.17 4.66 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.038 0.755 . . . . 20.0 113.038 -171.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -79.02 160.54 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.347 1.459 . . . . 20.0 111.69 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -132.92 179.09 6.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.481 1.512 . . . . 20.0 113.539 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.73 156.84 34.27 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.585 1.554 . . . . 20.0 111.023 168.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.76 1.624 . . . . 20.0 109.189 172.213 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 61.1 m-20 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 110.455 -0.202 . . . . 20.0 110.455 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -73.89 -75.3 0.16 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.186 0.595 . . . . 20.0 110.698 176.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 p -68.46 -28.25 66.88 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 114.557 1.317 . . . . 20.0 114.557 -167.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.0 t -57.27 -49.34 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.544 1.138 . . . . 20.0 109.617 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.4 t -71.65 -27.26 62.95 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.733 1.213 . . . . 20.0 112.786 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -67.52 -24.97 65.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.208 1.003 . . . . 20.0 112.419 175.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.23 -1.11 14.52 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.181 1.372 . . . . 20.0 114.176 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -77.95 172.14 13.93 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.753 1.277 . . . . 20.0 112.222 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.9 -7.04 29.73 Favored Glycine 0 C--N 1.341 0.839 0 N-CA-C 118.019 1.968 . . . . 20.0 118.019 -153.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.0 m 37.54 53.93 1.41 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.801 2.44 . . . . 20.0 113.76 -171.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.55 154.25 80.27 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 123.166 0.587 . . . . 20.0 109.646 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.7 161.97 41.41 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.86 2.373 . . . . 20.0 111.256 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -65.64 -18.33 65.24 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.403 0.681 . . . . 20.0 111.604 175.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.7 m -68.29 -43.57 77.42 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.681 1.192 . . . . 20.0 112.231 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -89.4 -48.34 7.4 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.821 0.848 . . . . 20.0 112.285 -174.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.19 118.92 51.28 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.004 1.321 . . . . 20.0 110.683 -176.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -71.06 157.99 56.32 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.916 2.41 . . . . 20.0 110.042 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -73.26 -16.58 61.39 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.0 0.92 . . . . 20.0 112.954 -164.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -72.44 -40.47 67.05 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.174 2.59 . . . . 20.0 112.221 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 -6.78 59.51 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.615 1.566 . . . . 20.0 113.616 -176.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -71.53 101.99 2.6 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 123.868 0.867 . . . . 20.0 111.036 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.73 170.86 7.19 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.085 1.754 . . . . 20.0 111.178 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.6 t -110.47 -3.21 16.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.486 1.514 . . . . 20.0 112.984 -174.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -63.74 175.38 1.13 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.243 1.817 . . . . 20.0 111.85 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.79 178.53 16.35 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.235 1.398 . . . . 20.0 112.754 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.06 -3.85 33.63 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.97 1.271 . . . . 20.0 115.085 171.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.7 m -77.48 176.38 8.94 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.196 1.498 . . . . 20.0 113.143 177.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -85.7 -17.67 35.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.728 -1.124 . . . . 20.0 110.84 166.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -143.08 -70.83 0.32 Allowed 'General case' 0 C--N 1.344 0.357 0 C-N-CA 125.428 1.491 . . . . 20.0 111.783 -168.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -164.88 137.38 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.506 1.522 . . . . 20.0 109.412 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -70.48 128.09 34.95 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.439 1.096 . . . . 20.0 109.491 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.8 t -130.89 114.71 15.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.574 1.149 . . . . 20.0 110.609 -172.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -67.11 121.4 15.53 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.327 0.584 . . . . 20.0 112.138 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.47 -26.22 14.91 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.694 1.198 . . . . 20.0 112.164 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.2 m -68.55 -10.94 58.93 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.397 1.479 . . . . 20.0 114.187 -173.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.3 ptmm? -135.55 5.32 3.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.419 1.887 . . . . 20.0 113.17 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.32 -44.28 68.57 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.915 1.286 . . . . 20.0 111.892 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.1 p -110.16 -75.69 0.62 Allowed 'General case' 0 C--N 1.344 0.366 0 C-N-CA 124.976 1.31 . . . . 20.0 111.316 -174.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 152.54 -98.7 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.453 1.025 . . . . 20.0 111.438 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.43 -37.66 73.14 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.192 1.397 . . . . 20.0 112.634 -176.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -70.95 -9.31 57.66 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.952 1.701 . . . . 20.0 114.108 -174.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.15 -61.94 5.9 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 124.558 1.075 . . . . 20.0 111.986 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -70.85 -21.9 62.38 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.858 1.663 . . . . 20.0 113.401 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 105.67 54.37 0.73 Allowed Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.559 1.076 . . . . 20.0 112.016 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.62 177.5 18.99 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 124.974 1.273 . . . . 20.0 113.357 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.32 157.53 45.42 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.563 1.545 . . . . 20.0 112.581 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -101.28 44.96 0.99 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.13 2.172 . . . . 20.0 111.185 -168.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -63.72 163.88 19.2 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.624 1.97 . . . . 20.0 113.49 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.31 163.46 34.36 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.824 3.016 . . . . 20.0 112.83 -177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.5 mt -68.04 -20.46 64.98 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.656 1.182 . . . . 20.0 112.003 171.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.99 -39.99 96.41 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.928 1.691 . . . . 20.0 111.031 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -74.37 132.45 42.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.305 1.042 . . . . 20.0 109.058 173.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.73 122.83 22.99 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.145 0.578 . . . . 20.0 110.062 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -168.7 166.44 11.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.401 1.48 . . . . 20.0 111.233 176.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -77.58 166.16 23.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.939 1.296 . . . . 20.0 110.665 174.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -132.6 140.65 48.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.449 1.499 . . . . 20.0 110.393 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.1 118.59 16.88 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.785 2.034 . . . . 20.0 110.885 -171.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -63.32 -17.45 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.986 1.314 . . . . 20.0 114.527 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.76 -20.38 61.19 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.95 1.3 . . . . 20.0 113.834 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -139.32 -37.0 0.51 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.97 . . . . 20.0 112.286 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.9 t -69.55 -21.55 63.62 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.749 1.219 . . . . 20.0 112.724 178.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.09 -8.78 18.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.888 0.875 . . . . 20.0 112.822 172.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.7 t -100.49 -26.76 13.74 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.288 1.435 . . . . 20.0 112.436 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 94.3 m -66.38 -44.64 82.57 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.178 0.899 . . . . 20.0 110.632 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 68.75 -179.27 22.87 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.603 1.097 . . . . 20.0 113.487 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -50.12 135.17 21.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.735 1.614 . . . . 20.0 112.398 -176.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.19 -28.58 15.08 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.194 1.854 . . . . 20.0 113.242 -175.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -142.51 -178.79 5.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.5 1.52 . . . . 20.0 111.734 -176.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -165.72 152.59 10.0 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.962 1.305 . . . . 20.0 111.361 -175.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.93 148.16 36.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.252 0.621 . . . . 20.0 110.128 166.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 20.2 t -149.21 140.82 23.44 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.918 1.687 . . . . 20.0 108.292 170.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 t -133.94 160.53 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.927 1.291 . . . . 20.0 109.257 -169.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -126.06 -178.21 4.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.077 1.351 . . . . 20.0 112.792 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.41 -11.1 8.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.938 1.295 . . . . 20.0 112.729 -175.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.175 1.39 . . . . 20.0 110.0 -175.805 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.4 p30 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.432 0.158 . . . . 20.0 111.421 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -127.17 -42.79 1.68 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.334 1.054 . . . . 20.0 111.876 -175.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -58.66 -38.51 78.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.269 0.627 . . . . 20.0 110.785 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.14 -43.26 95.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.489 1.516 . . . . 20.0 110.986 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.3 m -63.26 -36.25 83.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.408 1.083 . . . . 20.0 112.41 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.1 -12.06 60.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.875 1.27 . . . . 20.0 112.751 176.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.59 1.19 53.07 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.61 1.576 . . . . 20.0 115.008 173.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -79.54 179.92 7.2 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.61 1.564 . . . . 20.0 111.995 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.1 174.91 15.44 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.603 1.573 . . . . 20.0 113.064 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.3 m -118.24 41.87 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.134 1.374 . . . . 20.0 112.054 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 143.9 97.49 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 122.976 0.51 . . . . 20.0 109.885 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.58 166.62 29.33 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.439 2.759 . . . . 20.0 112.797 -173.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -64.38 -25.74 68.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.564 1.545 . . . . 20.0 112.362 178.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.2 m -77.72 -12.85 60.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.435 1.494 . . . . 20.0 113.815 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.87 -66.97 1.03 Allowed 'General case' 0 C--N 1.344 0.351 0 C-N-CA 124.577 1.151 . . . . 20.0 110.513 -170.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.4 158.54 28.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.462 0.705 . . . . 20.0 112.075 176.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -83.13 170.13 12.38 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.847 3.031 . . . . 20.0 111.892 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -83.77 -5.65 59.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.335 1.454 . . . . 20.0 113.337 -173.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -90.75 -32.43 16.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.82 2.048 . . . . 20.0 112.196 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.02 2.63 12.24 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.909 1.684 . . . . 20.0 113.672 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -85.7 102.73 13.87 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.221 1.008 . . . . 20.0 112.704 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.1 mt -74.77 176.42 7.05 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.346 1.858 . . . . 20.0 111.721 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.9 t -137.2 19.15 2.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.169 1.388 . . . . 20.0 113.226 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.06 -100.71 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.563 1.945 . . . . 20.0 111.176 171.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.16 177.8 28.8 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 128.178 2.799 . . . . 20.0 111.407 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.33 38.0 3.64 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 119.092 -0.838 . . . . 20.0 113.931 176.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 68.9 m -132.8 179.39 6.19 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.556 1.543 . . . . 20.0 111.171 176.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.1 m -108.65 -6.28 16.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.397 1.079 . . . . 20.0 112.284 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.1 p -136.77 -67.79 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.644 1.578 . . . . 20.0 109.852 174.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -165.81 163.2 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 127.75 2.42 . . . . 20.0 107.946 -173.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.8 m -97.49 157.73 15.85 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.556 0.743 . . . . 20.0 111.727 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.3 t -146.34 118.22 8.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.418 1.487 . . . . 20.0 109.94 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.96 96.89 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.424 1.09 . . . . 20.0 113.215 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.7 mt -69.26 -9.01 51.18 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.844 1.258 . . . . 20.0 113.585 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.1 t -101.1 -7.58 23.06 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.966 1.306 . . . . 20.0 112.795 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -124.66 0.79 8.17 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.882 1.673 . . . . 20.0 112.898 -177.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.64 -36.44 57.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.978 1.711 . . . . 20.0 112.424 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 65.8 p -128.65 168.83 15.22 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.793 1.637 . . . . 20.0 111.481 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 147.15 -164.04 28.65 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 125.45 1.5 . . . . 20.0 111.1 -176.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.3 m -75.07 -65.18 0.91 Allowed 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.465 -0.432 . . . . 20.0 110.312 165.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 tmtp? 52.93 17.74 0.94 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.497 1.919 . . . . 20.0 114.262 -174.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.36 -153.32 10.22 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 126.214 1.864 . . . . 20.0 111.693 173.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -65.6 -32.19 73.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.256 1.022 . . . . 20.0 112.753 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.66 -14.48 2.92 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.395 1.474 . . . . 20.0 114.407 174.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.67 172.11 48.62 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.353 1.454 . . . . 20.0 112.745 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -136.8 171.34 14.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.591 1.556 . . . . 20.0 111.438 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 57.3 m -74.68 25.09 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.138 2.175 . . . . 20.0 114.565 -172.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -55.46 154.02 13.08 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 125.088 1.355 . . . . 20.0 111.116 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.44 163.11 38.52 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.553 2.835 . . . . 20.0 111.782 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.76 -13.89 62.51 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.08 1.352 . . . . 20.0 112.512 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -68.87 -31.78 70.97 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.209 1.404 . . . . 20.0 111.825 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -72.39 135.05 45.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.596 0.758 . . . . 20.0 109.82 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -80.84 104.28 11.25 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.362 1.465 . . . . 20.0 110.952 -176.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.47 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 1.3 m -162.04 165.55 27.13 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.466 1.906 . . . . 20.0 110.274 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -68.48 162.11 26.29 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.37 1.068 . . . . 20.0 111.671 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -133.96 125.11 27.51 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.406 1.482 . . . . 20.0 110.855 -173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.9 pp -129.26 170.96 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.319 2.247 . . . . 20.0 110.817 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.67 -5.4 13.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.762 1.225 . . . . 20.0 112.018 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.6 -34.72 62.89 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.56 1.544 . . . . 20.0 113.131 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -138.34 -36.71 0.58 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.422 1.489 . . . . 20.0 111.855 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.6 p -90.12 48.47 1.57 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.079 1.752 . . . . 20.0 110.441 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -130.06 -7.68 4.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.635 1.974 . . . . 20.0 111.98 177.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.7 m -133.8 84.44 2.12 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.769 1.228 . . . . 20.0 111.354 -176.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.5 t -141.12 -55.72 0.49 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 155.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 160.6 -80.78 0.15 Allowed Glycine 0 C--N 1.341 0.861 0 CA-C-N 118.7 0.682 . . . . 20.0 112.175 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -80.24 65.3 5.35 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 126.443 1.897 . . . . 20.0 110.922 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 45.93 78.85 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 128.464 2.935 . . . . 20.0 112.443 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -63.68 133.84 54.32 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.448 -0.876 . . . . 20.0 109.204 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -142.39 130.64 22.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.115 0.966 . . . . 20.0 111.203 171.387 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.2 t -53.25 120.0 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.46 1.904 . . . . 20.0 111.722 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.9 t -158.97 85.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.743 0.817 . . . . 20.0 110.446 -172.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.56 10.67 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.406 1.082 . . . . 20.0 113.082 -174.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -84.52 178.64 7.63 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.688 1.595 . . . . 20.0 110.909 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.0 tt -84.91 -36.44 21.46 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.835 0.854 . . . . 20.0 110.987 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 . . . . . 0 C--O 1.249 1.059 0 C-N-CA 125.372 1.469 . . . . 20.0 109.714 -176.771 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 109.527 -0.546 . . . . 20.0 109.527 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.66 -38.63 91.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.285 0.634 . . . . 20.0 112.098 -175.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 t -61.31 -47.05 87.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.349 1.46 . . . . 20.0 111.871 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 88.8 t -77.58 -31.34 17.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.455 1.502 . . . . 20.0 111.411 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.2 m -63.7 -41.92 98.04 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.508 1.123 . . . . 20.0 111.738 173.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.55 -16.61 61.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.05 0.94 . . . . 20.0 112.879 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.64 52.67 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.786 1.184 . . . . 20.0 114.306 172.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -83.73 178.52 7.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.365 1.466 . . . . 20.0 112.321 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.52 175.26 15.67 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.493 1.521 . . . . 20.0 112.449 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.6 m -123.27 52.56 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.297 1.439 . . . . 20.0 111.144 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.65 153.04 88.47 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.008 0.923 . . . . 20.0 109.55 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.85 164.09 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.005 2.47 . . . . 20.0 111.63 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -62.42 -27.8 69.35 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.414 1.486 . . . . 20.0 111.229 172.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.6 m -64.66 -34.06 77.41 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 125.184 1.394 . . . . 20.0 112.473 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.37 -70.08 0.64 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.243 1.017 . . . . 20.0 110.518 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 m -69.94 144.22 92.8 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 124.168 0.987 . . . . 20.0 111.492 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.04 170.64 17.59 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.045 3.164 . . . . 20.0 111.781 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -70.44 -23.49 62.73 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.584 1.154 . . . . 20.0 113.218 -170.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -81.77 -36.88 28.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.265 2.226 . . . . 20.0 112.459 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.86 -8.07 52.14 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.928 1.291 . . . . 20.0 113.486 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -72.15 101.69 2.85 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.115 1.366 . . . . 20.0 110.813 -178.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.93 169.96 10.65 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.123 1.769 . . . . 20.0 111.742 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.6 p -98.17 -11.67 22.54 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.339 1.456 . . . . 20.0 113.743 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -69.42 163.62 24.84 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.437 1.095 . . . . 20.0 112.032 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.55 174.49 15.49 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.207 1.384 . . . . 20.0 111.849 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.29 -3.97 20.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.045 1.307 . . . . 20.0 113.787 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.32 179.41 5.89 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.263 1.425 . . . . 20.0 112.363 175.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -97.46 -13.67 21.61 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.64 1.176 . . . . 20.0 112.042 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -142.94 -71.07 0.32 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.761 1.624 . . . . 20.0 110.33 -173.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -159.1 145.29 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.461 1.104 . . . . 20.0 109.927 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.0 m -77.35 131.83 38.28 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.503 1.121 . . . . 20.0 109.702 169.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.6 t -124.32 118.8 27.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.623 1.169 . . . . 20.0 109.592 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.83 86.18 0.5 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.713 1.205 . . . . 20.0 112.536 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 mt -63.72 -30.97 72.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.517 1.127 . . . . 20.0 112.68 -178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.1 t -64.11 -34.77 78.81 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 123.919 0.888 . . . . 20.0 111.55 177.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -101.57 -1.12 33.63 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.304 1.042 . . . . 20.0 112.759 -174.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -79.84 -46.59 16.6 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.85 2.06 . . . . 20.0 110.43 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.1 t -78.48 172.68 13.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.78 1.632 . . . . 20.0 112.185 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.75 -118.39 1.41 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.796 1.665 . . . . 20.0 110.679 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -21.98 65.29 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.298 1.439 . . . . 20.0 113.618 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -55.98 -25.07 42.34 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.539 0.94 . . . . 20.0 113.539 169.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.97 82.39 0.32 Allowed Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.887 1.708 . . . . 20.0 110.386 175.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -77.79 -77.37 0.16 Allowed 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.211 1.404 . . . . 20.0 107.921 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.0 29.05 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.406 1.003 . . . . 20.0 113.012 -166.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.7 -125.14 3.05 Favored Glycine 0 C--N 1.343 0.942 0 C-N-CA 125.038 1.304 . . . . 20.0 111.513 -174.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.82 167.02 23.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.478 1.111 . . . . 20.0 112.653 -171.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 32.7 t -112.1 82.09 1.57 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.317 1.447 . . . . 20.0 109.937 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.6 164.64 36.63 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 126.04 1.736 . . . . 20.0 111.104 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.94 167.98 20.07 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.587 2.858 . . . . 20.0 112.921 -175.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.3 mt -64.63 -19.82 65.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.315 1.046 . . . . 20.0 112.65 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.29 -27.02 69.05 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.855 1.662 . . . . 20.0 111.926 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -70.46 127.84 34.11 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 125.021 1.328 . . . . 20.0 109.731 -177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -75.29 101.13 4.59 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.415 0.686 . . . . 20.0 110.247 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 p -160.97 -179.98 7.98 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.698 1.599 . . . . 20.0 111.194 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -59.38 165.54 2.72 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.715 2.006 . . . . 20.0 111.648 -177.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -139.44 128.55 23.81 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 125.855 1.662 . . . . 20.0 109.63 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.6 mt -150.79 115.29 5.16 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.422 1.889 . . . . 20.0 109.769 176.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -64.9 -18.93 65.63 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.529 0.936 . . . . 20.0 113.529 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.02 -17.21 60.55 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.964 1.305 . . . . 20.0 114.032 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -129.54 -49.99 1.16 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.707 1.203 . . . . 20.0 112.593 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.5 p -63.73 -18.59 64.19 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.025 1.12 . . . . 20.0 114.025 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.62 -13.5 42.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.467 1.507 . . . . 20.0 113.54 173.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 t -63.28 -46.03 88.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.522 1.129 . . . . 20.0 111.451 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -12.2 57.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.415 0.686 . . . . 20.0 112.539 169.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.61 -162.33 34.43 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.766 1.174 . . . . 20.0 112.664 178.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -74.83 46.46 0.29 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.511 1.924 . . . . 20.0 113.445 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.6 7.94 1.55 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 126.48 1.991 . . . . 20.0 112.528 173.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -144.86 161.74 38.56 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.848 1.259 . . . . 20.0 110.642 176.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.05 149.1 34.49 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.391 2.676 . . . . 20.0 108.444 173.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.6 t -52.64 109.0 0.35 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.854 0.862 . . . . 20.0 111.268 -173.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.36 18.29 13.68 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.154 0.982 . . . . 20.0 113.228 -167.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 t -138.64 116.76 12.73 Favored 'Isoleucine or valine' 0 C--N 1.343 0.3 0 C-N-CA 125.356 1.463 . . . . 20.0 107.995 -170.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -95.69 175.16 6.64 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.367 1.067 . . . . 20.0 110.858 175.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -60.65 2.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.671 0.788 . . . . 20.0 110.46 -171.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.9 t60 . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.836 1.654 . . . . 20.0 111.719 -178.858 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.881 0.372 . . . . 20.0 110.161 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -63.88 -37.62 88.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.629 1.572 . . . . 20.0 111.657 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -58.4 -54.78 43.11 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.324 1.45 . . . . 20.0 111.279 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 50.9 t -67.52 -34.4 68.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.119 1.368 . . . . 20.0 111.066 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.9 t -62.42 -41.48 98.72 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.101 1.361 . . . . 20.0 111.589 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -76.04 -14.02 60.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.609 1.164 . . . . 20.0 113.03 175.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.51 -2.03 53.41 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.781 1.658 . . . . 20.0 113.867 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -76.66 176.98 7.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.383 1.473 . . . . 20.0 111.714 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.79 176.45 18.16 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.886 1.232 . . . . 20.0 111.986 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -124.82 76.39 1.51 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.775 1.23 . . . . 20.0 108.702 172.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -77.53 156.1 81.0 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.339 1.056 . . . . 20.0 109.534 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.94 160.13 51.09 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.5 2.134 . . . . 20.0 111.34 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -64.75 -20.85 66.59 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.986 0.914 . . . . 20.0 112.715 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.0 t -68.11 -55.72 11.45 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.017 0.927 . . . . 20.0 110.896 172.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.03 -54.97 9.3 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.45 1.1 . . . . 20.0 111.775 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 t -62.35 115.86 19.02 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.363 1.065 . . . . 20.0 110.889 -177.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -69.04 156.45 65.18 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.785 2.323 . . . . 20.0 110.592 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -72.84 -17.0 61.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.819 0.848 . . . . 20.0 112.977 -166.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 4.7 pt-20 -72.61 -40.91 66.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.288 2.635 . . . . 20.0 111.97 173.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.37 -10.68 59.75 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.036 1.334 . . . . 20.0 112.937 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -66.46 119.5 11.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.202 1.001 . . . . 20.0 110.78 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -90.54 172.82 8.43 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.025 1.33 . . . . 20.0 110.715 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 t -87.54 -14.79 39.28 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.809 1.244 . . . . 20.0 112.204 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -63.64 165.34 8.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.408 1.483 . . . . 20.0 112.538 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.83 -168.77 11.9 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.177 1.37 . . . . 20.0 113.343 -171.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.2 -11.11 73.12 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.224 1.869 . . . . 20.0 113.421 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 77.2 m -67.17 172.23 4.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.62 1.168 . . . . 20.0 111.748 174.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.2 p -106.33 -5.77 18.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.097 1.759 . . . . 20.0 113.533 173.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -139.36 -72.64 0.39 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.266 1.827 . . . . 20.0 109.993 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -164.11 155.32 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.982 1.713 . . . . 20.0 109.002 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -76.02 160.02 30.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.883 0.873 . . . . 20.0 110.403 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.95 117.97 5.9 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.952 0.501 . . . . 20.0 110.825 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -71.74 93.74 1.31 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.805 1.242 . . . . 20.0 110.377 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.95 -22.28 64.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.452 1.101 . . . . 20.0 112.888 -177.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.0 t -74.14 -15.52 61.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.746 1.218 . . . . 20.0 113.023 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -129.25 9.0 5.6 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.767 1.627 . . . . 20.0 113.243 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tt -76.5 -54.12 7.15 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.772 1.229 . . . . 20.0 109.645 173.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 p -104.67 175.65 5.42 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.138 1.775 . . . . 20.0 111.599 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -160.54 -127.02 0.86 Allowed Glycine 0 C--N 1.343 0.96 0 C-N-CA 124.76 1.172 . . . . 20.0 111.123 -175.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.6 t -70.83 -67.5 0.5 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.144 0.978 . . . . 20.0 111.16 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -133.34 -49.58 0.85 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.817 1.247 . . . . 20.0 112.593 -162.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.28 -61.56 0.01 OUTLIER Glycine 0 C--N 1.344 1.005 0 C-N-CA 124.219 0.914 . . . . 20.0 113.0 -179.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -68.21 -44.82 74.94 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.378 1.471 . . . . 20.0 111.819 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 151.23 -25.25 0.99 Allowed Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.456 1.503 . . . . 20.0 112.881 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 98.86 156.57 29.24 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.637 1.589 . . . . 20.0 111.192 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -137.42 136.02 37.45 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 125.159 1.383 . . . . 20.0 109.34 -179.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.8 m -82.56 94.89 7.6 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.405 0.682 . . . . 20.0 109.518 174.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.63 154.7 60.12 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 125.809 1.643 . . . . 20.0 110.858 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -68.39 156.48 65.49 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.676 2.917 . . . . 20.0 112.362 -170.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.91 -19.84 65.8 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.595 0.758 . . . . 20.0 112.665 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -69.04 -27.02 65.27 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.929 1.692 . . . . 20.0 112.577 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -76.38 134.32 39.68 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.335 0.654 . . . . 20.0 109.993 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.15 99.22 0.87 Allowed 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.631 1.172 . . . . 20.0 110.157 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.33 173.43 8.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.866 1.266 . . . . 20.0 111.472 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -68.25 166.95 15.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.534 1.133 . . . . 20.0 111.439 177.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -142.95 140.19 31.0 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.188 1.795 . . . . 20.0 109.447 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.48 87.75 1.74 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.354 1.461 . . . . 20.0 111.337 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -68.18 -9.57 47.79 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.749 1.018 . . . . 20.0 113.749 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.43 -7.62 40.97 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.547 1.539 . . . . 20.0 113.534 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.25 -56.78 0.65 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.922 1.289 . . . . 20.0 111.047 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 t -66.27 -20.55 66.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.221 1.408 . . . . 20.0 113.184 -176.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.63 -6.65 1.21 Allowed 'General case' 0 C--N 1.344 0.365 0 C-N-CA 126.966 2.106 . . . . 20.0 114.963 -178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.1 t -54.58 -28.84 48.97 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.391 0.996 . . . . 20.0 113.362 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 68' ' ' GLN . 1.3 m -71.4 -75.69 0.12 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.22 1.008 . . . . 20.0 109.142 165.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 145.13 -62.64 0.47 Allowed Glycine 0 C--N 1.347 1.144 0 C-N-CA 123.918 0.771 . . . . 20.0 112.463 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 144.12 50.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.982 1.313 . . . . 20.0 110.291 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 55.59 46.92 80.19 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.037 1.303 . . . . 20.0 113.069 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.426 ' HB2' ' HB2' ' A' ' 64' ' ' CYS . 5.1 pm0 -127.5 -0.11 6.23 Favored 'General case' 0 C--N 1.347 0.471 0 N-CA-C 118.837 2.902 . . . . 20.0 118.837 -165.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -41.15 127.3 2.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.113 2.165 . . . . 20.0 113.981 -168.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 44.4 t -60.49 111.93 1.78 Allowed 'General case' 0 C--N 1.345 0.388 0 C-N-CA 123.904 0.881 . . . . 20.0 109.751 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.6 t -130.17 83.43 2.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.957 1.303 . . . . 20.0 108.332 -174.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.9 t -116.23 131.3 69.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.016 1.727 . . . . 20.0 108.276 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -94.47 174.89 6.9 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.924 1.29 . . . . 20.0 110.637 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.514 HD23 ' H ' ' A' ' 74' ' ' LEU . 2.5 pt? -78.51 177.39 8.58 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.721 -0.672 . . . . 20.0 111.927 172.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 t60 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 117.4 -1.286 . . . . 20.0 111.54 178.293 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 121.2 0.524 . . . . 20.0 111.015 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -59.67 -35.98 75.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.02 1.328 . . . . 20.0 112.964 -175.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.7 t -63.4 -35.99 82.23 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.473 1.109 . . . . 20.0 111.895 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.4 t -76.74 -41.95 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.376 1.47 . . . . 20.0 110.634 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.6 m -62.17 -38.65 89.87 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.88 1.272 . . . . 20.0 112.743 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -71.67 -15.94 62.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.736 1.214 . . . . 20.0 113.085 175.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.67 -1.07 56.77 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 125.211 1.386 . . . . 20.0 114.535 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -74.59 176.71 6.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.465 1.132 . . . . 20.0 111.333 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 178.65 19.18 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.049 1.309 . . . . 20.0 112.57 -176.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -131.63 68.31 1.5 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.383 1.473 . . . . 20.0 109.67 176.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.54 155.75 87.88 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 109.238 -0.653 . . . . 20.0 109.238 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.79 166.7 28.7 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.7 2.267 . . . . 20.0 111.018 174.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -63.64 -22.49 66.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.602 0.761 . . . . 20.0 111.753 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -74.04 -16.39 61.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.434 1.494 . . . . 20.0 113.899 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -126.1 -37.92 2.21 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.894 1.278 . . . . 20.0 112.597 -174.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -71.22 125.89 91.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 123.861 0.864 . . . . 20.0 110.039 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -69.12 153.53 71.74 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.688 2.258 . . . . 20.0 109.752 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -73.44 -14.4 61.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.361 1.065 . . . . 20.0 112.955 -167.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.434 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.7 pt-20 -76.56 -42.08 44.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.693 2.397 . . . . 20.0 112.226 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.9 -11.5 59.82 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.808 1.243 . . . . 20.0 113.577 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -67.34 108.07 2.63 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.301 1.04 . . . . 20.0 111.127 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.6 mt -76.07 172.39 12.86 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.883 1.273 . . . . 20.0 112.334 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 55.9 m -90.51 -11.22 40.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.192 1.397 . . . . 20.0 112.953 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -71.71 175.06 6.0 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.799 1.24 . . . . 20.0 112.96 -176.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.21 177.52 18.17 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.524 1.535 . . . . 20.0 112.681 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.34 -11.06 26.36 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.972 1.749 . . . . 20.0 113.373 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.2 m -74.67 178.36 5.47 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.395 1.478 . . . . 20.0 112.263 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 m -115.55 -5.17 12.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.164 1.386 . . . . 20.0 112.322 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -138.75 -74.63 0.38 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.683 1.993 . . . . 20.0 109.204 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -161.1 158.83 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 126.636 1.974 . . . . 20.0 108.271 179.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 31.8 m -75.18 163.07 27.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.808 0.843 . . . . 20.0 111.358 171.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.87 118.66 5.77 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.194 0.997 . . . . 20.0 110.084 170.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -69.3 100.45 1.34 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.811 1.245 . . . . 20.0 109.547 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 mt -67.95 -24.95 65.23 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.318 1.047 . . . . 20.0 112.267 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.8 t -74.93 -5.7 45.21 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.153 1.381 . . . . 20.0 112.499 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -121.22 10.04 10.56 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.934 1.694 . . . . 20.0 111.981 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 tp -106.76 -37.67 6.33 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.974 1.71 . . . . 20.0 111.043 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 65.0 p -122.48 150.14 42.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.547 1.939 . . . . 20.0 110.887 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.68 172.58 32.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.866 1.222 . . . . 20.0 113.001 -178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.1 m -81.17 -42.07 21.41 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.8 1.24 . . . . 20.0 111.933 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -137.4 -31.03 0.82 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.66 1.584 . . . . 20.0 112.139 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.8 67.85 0.8 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 124.936 1.255 . . . . 20.0 110.703 -176.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -131.38 -65.87 0.75 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.942 2.097 . . . . 20.0 108.72 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.56 -49.03 0.02 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.838 1.209 . . . . 20.0 111.705 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.39 101.11 0.69 Allowed Glycine 0 C--N 1.342 0.89 0 C-N-CA 124.454 1.026 . . . . 20.0 111.271 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.18 150.31 47.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.872 0.869 . . . . 20.0 111.472 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.4 t -110.87 28.66 8.49 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.821 1.648 . . . . 20.0 111.711 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -45.14 149.8 0.86 Allowed Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 127.809 2.444 . . . . 20.0 113.821 159.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.88 159.45 41.73 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.12 3.213 . . . . 20.0 112.84 -171.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.33 -18.78 64.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.332 1.053 . . . . 20.0 113.759 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.09 -29.8 67.97 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.994 1.318 . . . . 20.0 112.624 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -73.06 138.91 46.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.571 0.748 . . . . 20.0 110.664 -175.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -71.73 104.27 3.34 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.204 1.401 . . . . 20.0 111.329 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -163.5 177.99 8.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.034 1.734 . . . . 20.0 110.077 173.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -69.0 162.49 26.71 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.653 1.181 . . . . 20.0 110.814 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -148.32 134.76 19.62 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.785 1.234 . . . . 20.0 109.978 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.8 mt -146.18 110.91 5.19 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 126.594 1.958 . . . . 20.0 108.729 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.95 -21.67 66.24 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.114 0.783 . . . . 20.0 113.114 -176.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.05 -35.74 74.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.429 1.092 . . . . 20.0 112.185 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -108.24 -31.19 7.99 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.881 1.273 . . . . 20.0 111.89 -170.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.8 p -84.1 -4.8 59.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.283 1.433 . . . . 20.0 113.828 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.3 -9.1 37.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.454 1.102 . . . . 20.0 113.012 174.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.7 t -60.86 -56.34 22.28 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.529 1.532 . . . . 20.0 112.258 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -79.31 -12.45 59.93 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.805 0.73 . . . . 20.0 112.184 172.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.19 -164.81 44.43 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.741 1.162 . . . . 20.0 112.588 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -54.76 107.56 0.3 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.096 1.758 . . . . 20.0 111.635 177.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 134.18 -17.7 4.29 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.288 1.423 . . . . 20.0 112.824 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -110.59 147.99 33.09 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-N 118.967 1.383 . . . . 20.0 111.017 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -132.17 153.81 50.18 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.141 1.777 . . . . 20.0 109.706 175.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.2 t -66.89 96.77 0.44 Allowed 'General case' 0 C--N 1.346 0.443 0 C-N-CA 124.581 1.152 . . . . 20.0 110.92 -176.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 10.8 t -143.39 111.49 6.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.073 1.349 . . . . 20.0 109.811 -176.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.2 p -148.12 157.97 8.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.049 0.94 . . . . 20.0 110.302 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -130.88 178.81 6.38 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.429 1.492 . . . . 20.0 109.965 174.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -102.02 -14.55 17.1 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.393 1.077 . . . . 20.0 111.671 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.7 m80 . . . . . 0 C--O 1.25 1.104 0 C-N-CA 126.715 2.006 . . . . 20.0 109.255 178.906 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 120.884 0.373 . . . . 20.0 110.518 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -122.27 -38.58 2.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.646 1.978 . . . . 20.0 110.476 -175.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 m -68.64 -27.57 66.12 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.98 1.712 . . . . 20.0 112.774 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.2 -53.3 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.175 1.39 . . . . 20.0 109.981 169.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 t -61.77 -33.53 74.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.237 1.015 . . . . 20.0 112.274 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -72.91 -56.77 4.7 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.566 1.146 . . . . 20.0 110.561 173.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.22 53.07 0.4 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.497 1.522 . . . . 20.0 112.978 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -116.98 179.71 3.94 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.671 1.589 . . . . 20.0 111.396 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.28 168.4 19.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.218 0.914 . . . . 20.0 112.697 -175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.8 m -120.58 83.93 2.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.235 1.414 . . . . 20.0 108.897 174.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -98.78 155.65 36.45 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.669 1.188 . . . . 20.0 108.468 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.86 162.15 42.83 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.652 2.235 . . . . 20.0 111.184 173.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -62.23 -28.42 69.68 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.7 1.2 . . . . 20.0 111.329 173.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -73.2 -16.14 61.43 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.719 1.208 . . . . 20.0 113.818 175.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -97.39 -66.27 0.91 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.415 1.086 . . . . 20.0 110.34 175.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.6 m -72.0 143.18 86.11 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.876 0.87 . . . . 20.0 111.234 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.21 173.38 13.09 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 124.384 3.389 . . . . 20.0 111.178 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -74.04 7.77 2.47 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.564 1.546 . . . . 20.0 113.841 -172.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -123.54 -38.13 2.57 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.624 1.97 . . . . 20.0 112.699 -172.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.59 -15.4 63.41 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.339 1.056 . . . . 20.0 113.304 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.77 109.86 3.54 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 126.118 1.767 . . . . 20.0 110.421 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.35 169.58 17.37 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.393 1.477 . . . . 20.0 111.683 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -103.22 -6.64 21.9 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.103 1.361 . . . . 20.0 112.813 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.44 176.07 1.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.881 1.672 . . . . 20.0 111.215 167.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.34 174.49 22.85 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 123.865 0.745 . . . . 20.0 113.6 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.03 -4.42 20.5 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 126.182 1.849 . . . . 20.0 114.384 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.3 m -73.22 -177.52 2.56 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.68 1.24 . . . . 20.0 111.471 165.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.1 m -99.52 -10.69 21.82 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.813 0.845 . . . . 20.0 111.899 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.4 p -138.95 -70.68 0.41 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.955 1.702 . . . . 20.0 109.513 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -157.47 144.37 9.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.117 1.367 . . . . 20.0 109.186 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.45 132.92 35.34 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.482 0.713 . . . . 20.0 109.619 173.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.8 t -126.19 114.93 18.98 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.961 1.304 . . . . 20.0 109.613 -174.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -67.38 99.83 0.77 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 124.788 1.235 . . . . 20.0 110.106 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.4 mt -68.73 -27.89 66.33 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.303 1.041 . . . . 20.0 112.149 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -72.98 -10.12 59.46 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.053 1.341 . . . . 20.0 112.957 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -121.58 21.88 10.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.613 1.565 . . . . 20.0 111.175 174.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.82 -59.46 1.96 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.313 1.845 . . . . 20.0 108.295 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 76.5 p -90.95 156.51 17.92 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.085 1.354 . . . . 20.0 111.165 178.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 142.05 -176.73 21.92 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.4 1.476 . . . . 20.0 111.581 -175.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.61 -25.6 64.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.044 0.937 . . . . 20.0 112.76 171.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -61.05 -12.26 11.25 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.776 1.63 . . . . 20.0 114.0 169.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -70.26 -87.5 0.11 Allowed Glycine 0 C--N 1.342 0.907 0 C-N-CA 125.604 1.574 . . . . 20.0 111.148 178.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.5 -53.59 5.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.175 0.99 . . . . 20.0 110.173 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 161.63 -15.79 0.16 Allowed Glycine 0 CA--C 1.534 1.277 0 CA-C-O 118.63 -1.094 . . . . 20.0 114.468 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.98 176.4 37.98 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.618 1.209 . . . . 20.0 113.449 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -145.59 157.64 43.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.61 1.164 . . . . 20.0 110.924 177.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.5 t -86.62 22.5 1.89 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.422 2.289 . . . . 20.0 112.127 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -58.93 148.91 68.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.893 1.277 . . . . 20.0 111.049 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.75 166.09 28.75 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 124.242 3.295 . . . . 20.0 113.469 -166.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.72 -23.85 65.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.378 1.071 . . . . 20.0 112.605 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -71.92 -13.03 61.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.261 1.424 . . . . 20.0 113.085 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.3 tpt85 -78.71 153.52 30.82 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.518 1.127 . . . . 20.0 110.269 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -102.68 101.63 11.76 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.533 1.133 . . . . 20.0 109.443 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 p -169.63 161.44 9.43 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.176 1.79 . . . . 20.0 111.077 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -80.88 110.14 16.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.087 1.755 . . . . 20.0 111.447 -173.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -79.6 151.41 30.63 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.46 0.704 . . . . 20.0 110.573 168.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.79 16.48 2.5 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.895 1.678 . . . . 20.0 114.54 175.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 51.85 21.37 1.42 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 130.251 3.42 . . . . 20.0 116.989 169.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -129.3 -71.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.271 1.429 . . . . 20.0 110.402 -167.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -63.47 -36.69 84.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 20.0 111.23 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.2 t -69.12 -32.03 71.15 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.18 1.792 . . . . 20.0 113.441 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.35 -7.06 16.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.009 1.324 . . . . 20.0 114.341 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.8 m -59.65 -42.6 93.16 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.227 1.411 . . . . 20.0 111.844 171.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 19.4 m -79.13 -11.47 59.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.839 1.256 . . . . 20.0 113.331 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 88.57 -98.83 2.47 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 125.319 1.438 . . . . 20.0 111.467 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -132.08 161.5 33.1 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.749 1.619 . . . . 20.0 110.588 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.63 -8.3 74.31 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.965 1.269 . . . . 20.0 113.598 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -123.75 178.61 5.15 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.849 1.66 . . . . 20.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -146.18 162.89 37.02 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.134 1.774 . . . . 20.0 110.537 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.65 123.27 17.45 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 107.738 -1.208 . . . . 20.0 107.738 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.1 t -140.03 105.83 5.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.272 0.629 . . . . 20.0 109.875 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.3 p -145.36 146.96 19.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.981 1.312 . . . . 20.0 109.345 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -112.39 177.21 4.72 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.263 1.425 . . . . 20.0 110.857 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.2 tp -82.01 -169.82 2.57 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.462 1.105 . . . . 20.0 110.543 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 126.079 1.751 . . . . 20.0 113.854 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 20.1 p30 . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.772 0.32 . . . . 20.0 111.344 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -121.6 -42.99 2.4 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.861 1.264 . . . . 20.0 111.487 -177.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.2 m -61.92 -34.89 76.89 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.477 0.711 . . . . 20.0 111.392 176.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.29 -49.55 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.282 1.433 . . . . 20.0 110.367 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 t -63.89 -33.41 75.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.98 1.312 . . . . 20.0 112.455 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -82.4 -8.25 59.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.52 1.528 . . . . 20.0 113.104 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.29 15.32 41.69 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.558 1.075 . . . . 20.0 114.512 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -100.34 -177.57 3.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.052 1.741 . . . . 20.0 111.695 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.3 170.08 15.62 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.28 1.419 . . . . 20.0 112.525 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.6 m -113.62 78.84 1.18 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.006 1.322 . . . . 20.0 109.834 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.13 156.78 74.07 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.972 0.909 . . . . 20.0 109.491 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.05 161.65 45.19 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.771 2.314 . . . . 20.0 110.694 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -64.06 -29.92 71.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.898 0.879 . . . . 20.0 111.17 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 t -62.66 -36.15 81.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.613 1.165 . . . . 20.0 112.542 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -86.89 -58.09 2.73 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.943 0.897 . . . . 20.0 111.047 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.9 t -67.42 118.48 57.1 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.955 1.302 . . . . 20.0 110.978 -176.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -71.46 162.25 42.9 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.321 2.681 . . . . 20.0 110.845 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.52 -14.69 61.26 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.427 1.091 . . . . 20.0 113.461 -166.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.38 -34.04 65.34 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 128.226 2.61 . . . . 20.0 112.244 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.12 -6.43 38.44 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.197 1.799 . . . . 20.0 114.104 -173.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.52 105.53 3.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.079 0.951 . . . . 20.0 110.434 177.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.36 169.44 12.31 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.494 . . . . 20.0 111.808 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.3 t -93.8 -15.04 25.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.781 1.233 . . . . 20.0 112.677 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 22.9 m-85 -63.57 170.61 3.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.703 1.601 . . . . 20.0 111.491 170.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -147.25 -178.65 22.69 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.134 0.874 . . . . 20.0 113.587 -176.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.66 -13.18 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.627 2.061 . . . . 20.0 113.65 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 87.8 m -69.32 176.29 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.57 1.548 . . . . 20.0 112.909 179.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.3 t -90.64 -15.68 30.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.65 0.78 . . . . 20.0 111.077 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.4 p -137.69 -74.78 0.41 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 20.0 109.65 -176.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -161.98 161.06 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.236 1.814 . . . . 20.0 108.525 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.8 m -92.29 162.55 14.24 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.435 0.694 . . . . 20.0 110.965 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -146.85 121.15 9.58 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.013 0.925 . . . . 20.0 109.378 177.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -70.79 92.74 0.91 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.944 0.897 . . . . 20.0 111.563 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -64.11 -30.26 71.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.842 1.257 . . . . 20.0 112.485 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.7 p -71.23 -7.72 48.74 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.943 1.697 . . . . 20.0 113.507 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -123.54 1.52 8.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.387 1.475 . . . . 20.0 112.862 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.03 -56.3 2.53 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.205 1.802 . . . . 20.0 109.357 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 48.1 p -61.27 167.11 3.35 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.873 2.069 . . . . 20.0 113.743 -175.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.75 -102.37 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.771 1.653 . . . . 20.0 109.782 175.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.04 -41.53 61.64 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.045 0.938 . . . . 20.0 113.065 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 ttmp? -142.9 -73.65 0.29 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.474 1.109 . . . . 20.0 110.614 -175.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.6 -67.48 0.06 OUTLIER Glycine 0 C--N 1.34 0.791 0 C-N-CA 125.18 1.371 . . . . 20.0 110.818 -174.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -71.17 -13.99 62.12 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.535 1.534 . . . . 20.0 113.852 174.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.1 -22.37 36.9 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.612 1.577 . . . . 20.0 114.012 174.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.67 173.97 43.73 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.677 1.608 . . . . 20.0 114.183 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -138.16 169.06 18.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.144 1.378 . . . . 20.0 112.99 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 12.0 t -95.8 33.91 1.6 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.032 2.133 . . . . 20.0 112.164 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.44 156.11 44.05 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.633 1.573 . . . . 20.0 112.895 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.46 159.42 44.4 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.711 3.607 . . . . 20.0 112.08 -171.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.2 -21.14 64.88 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.019 1.328 . . . . 20.0 112.518 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.29 -25.33 66.8 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.743 1.617 . . . . 20.0 112.836 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.55 150.97 42.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.817 1.247 . . . . 20.0 110.536 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -134.02 102.47 5.43 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.906 1.282 . . . . 20.0 109.188 -179.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.39 -87.73 0.08 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.444 1.897 . . . . 20.0 107.739 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -146.57 165.82 28.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.203 1.801 . . . . 20.0 109.302 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.96 163.53 32.72 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.977 0.911 . . . . 20.0 111.238 170.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.2 tp -169.23 109.92 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 107.498 -1.297 . . . . 20.0 107.498 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -67.1 -18.93 65.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.305 1.442 . . . . 20.0 114.147 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.7 -27.7 66.67 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.005 1.113 . . . . 20.0 114.005 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -127.5 -30.56 2.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.767 1.227 . . . . 20.0 111.832 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 54.7 p -70.46 -22.65 62.66 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.894 1.072 . . . . 20.0 113.894 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.28 -6.38 6.79 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.617 1.567 . . . . 20.0 114.412 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m -126.45 67.81 1.23 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.552 1.541 . . . . 20.0 109.401 167.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.86 -27.72 2.06 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.002 1.321 . . . . 20.0 113.934 171.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.62 -92.15 0.23 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 124.836 1.207 . . . . 20.0 111.923 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -77.13 41.33 0.29 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.97 2.108 . . . . 20.0 112.828 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.72 60.07 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 C-N-CA 123.75 0.69 . . . . 20.0 113.429 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -86.03 79.76 9.07 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 123.069 1.414 . . . . 20.0 111.314 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.66 119.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 128.395 2.678 . . . . 20.0 110.031 166.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -72.72 88.37 1.29 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.056 0.455 . . . . 20.0 110.807 176.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 26.4 t -81.53 132.77 35.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.459 1.904 . . . . 20.0 110.263 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.2 p -153.48 162.2 2.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.523 0.729 . . . . 20.0 110.379 174.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -129.03 178.31 6.49 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.969 1.707 . . . . 20.0 111.066 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.95 -175.71 1.52 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.206 1.402 . . . . 20.0 111.946 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.8 p80 . . . . . 0 C--O 1.251 1.162 0 C-N-CA 126.124 1.769 . . . . 20.0 113.849 -176.443 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.3 p30 . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 111.468 0.173 . . . . 20.0 111.468 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -121.96 -51.37 2.02 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.624 1.169 . . . . 20.0 110.3 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.7 m -62.74 -36.47 83.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.708 1.203 . . . . 20.0 111.523 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.14 -43.49 95.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.508 1.523 . . . . 20.0 110.013 174.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 t -62.6 -38.41 90.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.082 0.953 . . . . 20.0 111.839 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -70.75 -30.07 66.48 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.484 1.114 . . . . 20.0 112.16 176.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.72 -2.23 23.17 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.771 1.653 . . . . 20.0 114.619 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -71.98 -179.15 2.63 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.349 1.86 . . . . 20.0 112.277 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.81 171.9 18.43 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 124.785 1.184 . . . . 20.0 113.195 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -113.2 82.35 1.65 Allowed 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.68 1.592 . . . . 20.0 109.837 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -86.64 156.04 56.12 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.408 1.083 . . . . 20.0 109.253 173.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.31 164.69 34.88 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.741 2.294 . . . . 20.0 110.809 170.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -64.52 -25.61 68.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.757 1.223 . . . . 20.0 112.013 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 t -69.59 -36.39 76.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.287 1.035 . . . . 20.0 112.124 177.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -86.62 -52.84 5.3 Favored 'General case' 0 C--N 1.344 0.349 0 C-N-CA 124.151 0.98 . . . . 20.0 111.475 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.1 t -67.2 119.33 63.93 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 124.36 1.064 . . . . 20.0 110.497 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -69.45 158.42 57.43 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.807 2.338 . . . . 20.0 110.321 175.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -73.44 -16.34 61.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.357 1.063 . . . . 20.0 112.878 -165.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.55 -40.75 48.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.597 2.359 . . . . 20.0 111.772 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.23 -4.71 51.93 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.872 1.669 . . . . 20.0 113.833 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.94 107.9 5.57 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 124.275 1.03 . . . . 20.0 110.84 -179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.04 170.65 10.95 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.911 1.684 . . . . 20.0 112.196 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 t -99.78 -11.11 21.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.571 1.548 . . . . 20.0 112.55 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -65.24 174.61 1.98 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.226 1.811 . . . . 20.0 111.306 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.92 176.75 25.64 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.669 0.652 . . . . 20.0 113.406 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.07 -12.71 17.03 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.136 1.826 . . . . 20.0 113.862 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -69.01 175.86 3.49 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.725 1.262 . . . . 20.0 112.323 173.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.6 p -85.07 -22.85 28.8 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 124.529 1.132 . . . . 20.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 p -140.9 -67.71 0.41 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.086 1.354 . . . . 20.0 110.297 -170.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.7 147.47 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 125.179 1.392 . . . . 20.0 109.862 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.9 m -87.32 131.02 34.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.741 1.216 . . . . 20.0 110.129 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 t -124.6 127.55 47.54 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.517 1.127 . . . . 20.0 109.701 -174.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -76.75 80.95 3.36 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.903 0.881 . . . . 20.0 113.3 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.62 -26.82 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.531 1.532 . . . . 20.0 113.95 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.6 m -67.3 -18.68 65.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.347 1.059 . . . . 20.0 113.048 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -136.12 7.25 3.14 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.78 1.632 . . . . 20.0 113.545 -176.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 tp -67.82 -45.38 74.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.192 1.397 . . . . 20.0 110.65 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -113.61 -70.48 0.8 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.363 1.465 . . . . 20.0 111.271 -171.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -161.23 -164.66 16.53 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.951 0.786 . . . . 20.0 112.89 -172.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.0 m -47.5 -56.48 6.98 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.368 1.867 . . . . 20.0 111.339 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.4 tttt 58.99 15.6 4.08 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 127.002 2.121 . . . . 20.0 114.955 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.3 -65.88 2.58 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.561 1.553 . . . . 20.0 113.174 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -125.91 -24.89 3.7 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.839 1.256 . . . . 20.0 113.779 -174.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 137.61 20.3 0.55 Allowed Glycine 0 CA--C 1.53 0.998 0 CA-C-O 118.805 -0.997 . . . . 20.0 114.185 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.61 -161.19 3.68 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.536 1.541 . . . . 20.0 113.986 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -139.82 140.62 36.65 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.153 1.381 . . . . 20.0 110.593 -172.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.43 122.25 32.45 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.559 0.744 . . . . 20.0 109.956 165.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -137.45 154.97 75.68 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.81 2.044 . . . . 20.0 110.035 173.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.81 164.99 19.76 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.724 3.616 . . . . 20.0 114.409 -165.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.23 -15.04 30.53 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.163 1.385 . . . . 20.0 113.834 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -88.91 -6.55 57.22 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.425 1.49 . . . . 20.0 113.922 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -67.28 -22.26 65.66 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.588 1.155 . . . . 20.0 114.107 -170.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 67.06 1.8 2.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.458 1.903 . . . . 20.0 114.525 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -63.58 -87.83 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.26 1.824 . . . . 20.0 112.207 -175.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -153.79 161.45 42.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.634 1.974 . . . . 20.0 109.121 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -128.24 141.23 51.52 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.781 2.032 . . . . 20.0 109.684 176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 68.0 mt -139.7 105.22 5.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.518 1.927 . . . . 20.0 108.889 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -63.54 -20.85 65.96 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.822 1.192 . . . . 20.0 113.46 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.06 -15.96 60.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.814 1.246 . . . . 20.0 113.983 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -129.83 -44.88 1.18 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.712 1.205 . . . . 20.0 112.138 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 m -66.47 -28.98 69.01 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 125.202 1.401 . . . . 20.0 113.228 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.11 -14.97 58.53 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.4 . . . . 20.0 112.992 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.4 m -68.44 -51.02 48.26 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 125.533 1.533 . . . . 20.0 111.616 173.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 23.3 m -69.1 -26.75 65.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.922 0.889 . . . . 20.0 111.517 169.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.24 -179.06 19.36 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.729 1.633 . . . . 20.0 113.278 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.33 45.3 0.37 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.282 2.633 . . . . 20.0 113.194 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -143.49 -2.72 0.91 Allowed Glycine 0 CA--C 1.535 1.311 0 C-N-CA 126.972 2.225 . . . . 20.0 113.018 176.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -135.87 171.21 14.79 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.048 1.424 . . . . 20.0 111.297 176.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -144.34 120.44 10.77 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.308 2.243 . . . . 20.0 110.509 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -81.09 125.49 30.28 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.262 1.425 . . . . 20.0 112.027 -165.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 35.8 m -71.99 -12.58 61.3 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 115.006 1.484 . . . . 20.0 115.006 -179.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 p -71.52 171.75 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.454 1.101 . . . . 20.0 112.069 -173.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -123.02 178.74 4.93 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.912 1.685 . . . . 20.0 111.083 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.6 mt -126.65 159.33 33.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.923 1.689 . . . . 20.0 110.261 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . 0.263 44.6 p-80 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 128.885 2.874 . . . . 20.0 114.168 -170.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.939 -0.393 . . . . 20.0 109.939 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.84 -39.66 93.93 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.849 0.86 . . . . 20.0 112.593 -173.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -63.79 -33.9 76.7 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.993 . . . . 20.0 111.754 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -42.6 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 125.274 1.43 . . . . 20.0 110.843 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 t -59.52 -45.03 92.93 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.864 1.666 . . . . 20.0 111.889 -177.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -69.06 -13.06 62.22 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.808 1.243 . . . . 20.0 113.443 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.28 5.75 57.95 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 125.4 1.476 . . . . 20.0 114.036 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -81.01 177.29 9.15 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.271 1.028 . . . . 20.0 112.011 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.97 177.05 18.0 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.235 1.398 . . . . 20.0 112.222 -174.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.4 m -131.24 71.91 1.49 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.922 1.289 . . . . 20.0 110.27 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.87 159.21 83.52 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.832 1.253 . . . . 20.0 109.696 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.73 161.04 47.48 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.391 2.061 . . . . 20.0 110.65 172.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.61 -21.47 66.72 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.0 0.92 . . . . 20.0 111.779 176.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.4 m -71.01 -17.98 62.61 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.541 1.536 . . . . 20.0 114.167 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.76 -46.12 2.66 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.558 1.143 . . . . 20.0 111.319 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.4 t -66.61 119.03 59.93 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 123.53 0.732 . . . . 20.0 110.537 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -71.33 161.25 46.29 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.327 2.684 . . . . 20.0 110.477 175.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -76.12 -13.5 60.2 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.416 0.895 . . . . 20.0 113.416 -166.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.07 -42.76 62.72 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.701 2.4 . . . . 20.0 111.794 171.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.72 -9.46 59.43 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.231 1.413 . . . . 20.0 113.482 -175.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.68 102.77 2.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.805 1.242 . . . . 20.0 111.33 -177.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 mt -75.57 167.12 22.5 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.872 1.269 . . . . 20.0 112.166 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -87.67 -12.14 46.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 20.0 112.773 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.89 170.39 11.26 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.744 1.217 . . . . 20.0 111.912 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.12 177.76 17.23 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.113 1.34 . . . . 20.0 112.669 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.03 -8.63 25.23 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.854 1.692 . . . . 20.0 113.53 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.0 m -77.52 175.83 9.47 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.555 1.142 . . . . 20.0 112.42 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -114.2 -5.06 13.02 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.317 1.447 . . . . 20.0 111.99 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.8 p -137.33 -71.83 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.998 1.719 . . . . 20.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -163.65 153.18 2.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.084 1.754 . . . . 20.0 109.42 177.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.94 157.32 38.38 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.853 0.861 . . . . 20.0 111.823 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -153.29 119.1 5.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.009 0.924 . . . . 20.0 110.185 174.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -71.76 90.51 1.09 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.017 0.927 . . . . 20.0 112.587 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.93 -37.61 82.91 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.66 1.184 . . . . 20.0 112.681 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.2 p -73.84 -5.54 41.56 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.872 1.269 . . . . 20.0 113.774 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mtmt -129.9 5.93 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.505 1.522 . . . . 20.0 113.116 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.7 tp -69.22 -49.14 59.18 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 126.083 1.753 . . . . 20.0 112.03 -170.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 28.46 81.9 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.302 3.041 . . . . 20.0 113.656 -175.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -161.69 164.58 35.27 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 125.246 1.403 . . . . 20.0 111.983 177.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -42.15 70.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.795 0.838 . . . . 20.0 112.412 -170.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -67.51 -14.95 63.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.306 1.042 . . . . 20.0 113.16 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.4 -20.47 58.82 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 125.08 1.324 . . . . 20.0 114.2 175.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -124.32 -22.74 4.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.749 2.02 . . . . 20.0 111.518 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.13 68.54 1.46 Allowed Glycine 0 C--N 1.343 0.936 0 N-CA-C 109.788 -1.325 . . . . 20.0 109.788 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.88 165.26 48.64 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.142 0.877 . . . . 20.0 113.645 -174.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 0.6 OUTLIER -86.54 168.23 13.88 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.56 1.144 . . . . 20.0 111.541 -179.54 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 69.7 m -112.55 107.83 16.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.29 1.036 . . . . 20.0 110.27 175.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -129.09 159.14 70.39 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.953 2.101 . . . . 20.0 109.411 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.48 170.86 15.26 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.088 2.525 . . . . 20.0 113.07 -171.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.2 mt -54.14 -35.9 62.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.727 1.211 . . . . 20.0 112.479 169.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -79.84 4.89 15.16 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.81 1.644 . . . . 20.0 113.665 -175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -64.3 -13.23 48.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.186 1.394 . . . . 20.0 113.573 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? 72.29 2.69 4.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.048 2.139 . . . . 20.0 112.976 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 165.92 3.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.313 1.845 . . . . 20.0 111.064 167.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -139.44 92.1 2.55 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 123.922 0.889 . . . . 20.0 110.682 -172.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -154.88 -173.49 4.59 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.39 1.476 . . . . 20.0 110.058 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -55.98 152.58 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.184 1.394 . . . . 20.0 113.02 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -131.64 2.46 4.11 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.641 1.176 . . . . 20.0 112.381 -171.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.09 -78.33 0.18 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.139 1.376 . . . . 20.0 110.916 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -68.77 -33.11 73.34 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.885 1.274 . . . . 20.0 112.437 -175.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.1 m -62.16 -31.16 71.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.116 1.366 . . . . 20.0 112.251 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.5 -9.74 37.64 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 114.866 1.432 . . . . 20.0 114.866 -172.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.9 t -58.34 -16.7 15.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.682 1.593 . . . . 20.0 114.181 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -17.55 53.24 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.19 1.182 . . . . 20.0 114.19 -176.349 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 138.71 -81.02 0.27 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.027 0.822 . . . . 20.0 112.755 171.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.48 59.82 3.05 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.051 1.74 . . . . 20.0 111.965 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 48.93 23.95 4.0 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 129.863 3.601 . . . . 20.0 114.931 -176.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -41.69 146.02 0.27 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 128.213 2.605 . . . . 20.0 112.715 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -135.46 133.38 38.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.552 -1.204 . . . . 20.0 109.704 -177.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.45 131.93 29.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 124.314 1.009 . . . . 20.0 110.961 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.9 t -138.9 20.93 2.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.993 1.317 . . . . 20.0 111.525 -171.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 95.3 t -60.53 140.44 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 125.044 1.338 . . . . 20.0 109.776 170.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -125.36 176.05 7.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.896 1.679 . . . . 20.0 110.245 175.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.08 162.41 26.7 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.334 0.653 . . . . 20.0 110.794 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 117.328 -1.32 . . . . 20.0 110.478 175.113 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 . . . . . 0 N--CA 1.474 0.754 0 CA-C-O 121.173 0.511 . . . . 20.0 110.844 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -64.99 -41.34 95.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.15 0.98 . . . . 20.0 112.999 -170.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.7 m -58.05 -52.48 65.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.033 0.933 . . . . 20.0 110.902 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.38 -36.23 77.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.956 1.702 . . . . 20.0 111.414 -176.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 t -64.84 -35.97 82.83 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.674 1.189 . . . . 20.0 111.99 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -77.78 -18.13 56.76 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.543 0.737 . . . . 20.0 111.895 174.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.19 -7.67 35.21 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 126.598 2.047 . . . . 20.0 113.144 177.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -70.4 174.74 5.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.94 1.696 . . . . 20.0 112.279 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.71 -176.5 14.46 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.996 1.284 . . . . 20.0 112.604 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.1 m -125.74 58.55 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.414 1.485 . . . . 20.0 110.758 -173.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.83 156.42 87.11 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 125.035 1.334 . . . . 20.0 110.015 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -70.9 162.73 41.63 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.595 2.197 . . . . 20.0 110.875 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -65.6 -16.62 63.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.572 0.749 . . . . 20.0 111.962 173.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.9 m -72.84 -28.61 62.64 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.506 1.522 . . . . 20.0 113.067 173.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -107.59 -47.87 3.54 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.533 1.133 . . . . 20.0 111.24 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.2 t -65.94 121.04 73.96 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.909 1.284 . . . . 20.0 109.776 172.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.81 170.18 18.45 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.54 2.827 . . . . 20.0 110.499 174.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -77.94 -10.73 59.73 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.658 0.985 . . . . 20.0 113.658 -171.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.8 pt-20 -85.34 -37.46 19.89 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.89 2.076 . . . . 20.0 112.316 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 -2.85 43.12 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.35 1.86 . . . . 20.0 113.657 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.94 97.97 4.12 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 124.571 1.148 . . . . 20.0 110.997 -174.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.89 168.34 13.78 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.967 1.707 . . . . 20.0 111.402 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -85.45 -15.26 43.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.626 1.17 . . . . 20.0 112.971 -177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -66.37 167.67 10.14 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.431 1.492 . . . . 20.0 112.056 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.49 178.44 19.98 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.873 1.225 . . . . 20.0 112.265 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.88 -11.73 29.65 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 125.47 1.509 . . . . 20.0 113.02 -176.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.3 m -67.16 176.33 2.23 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.367 1.467 . . . . 20.0 112.537 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.7 t -101.14 -12.43 18.79 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.722 1.209 . . . . 20.0 111.736 174.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -139.64 -74.04 0.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.939 1.696 . . . . 20.0 109.807 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -163.89 143.42 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 125.047 1.339 . . . . 20.0 109.802 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.7 t -74.26 139.52 44.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.137 0.975 . . . . 20.0 109.704 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -138.3 124.81 20.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.641 0.776 . . . . 20.0 110.712 -175.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -73.09 82.06 1.27 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.046 0.939 . . . . 20.0 112.45 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.44 -31.67 72.89 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.747 1.219 . . . . 20.0 113.134 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -71.85 -11.98 61.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.572 1.149 . . . . 20.0 112.832 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -125.09 5.04 7.9 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.8 1.64 . . . . 20.0 112.957 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -46.02 14.86 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.996 1.718 . . . . 20.0 109.964 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -141.28 -47.47 0.39 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.741 1.616 . . . . 20.0 111.048 -176.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.85 -31.98 6.47 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 125.96 1.743 . . . . 20.0 113.138 -178.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.469 ' HA ' HD11 ' A' ' 57' ' ' LEU . 3.2 t -75.9 -22.13 56.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.446 1.123 . . . . 20.0 113.115 174.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 tttm 65.1 23.78 12.42 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 20.0 113.087 161.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -150.37 113.92 0.62 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 125.111 1.338 . . . . 20.0 110.751 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.1 ttpt 60.99 11.85 3.58 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 128.757 2.823 . . . . 20.0 114.916 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 -11.98 70.15 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 126.25 1.881 . . . . 20.0 112.865 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.5 108.66 0.07 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.212 1.863 . . . . 20.0 113.389 174.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.37 179.21 5.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.549 1.14 . . . . 20.0 111.021 168.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.4 t -137.55 57.34 1.74 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.166 0.986 . . . . 20.0 110.686 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.4 159.25 74.07 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.956 1.702 . . . . 20.0 112.08 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.07 164.12 31.32 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.524 2.816 . . . . 20.0 113.117 -176.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.27 -16.23 64.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.855 0.862 . . . . 20.0 112.607 172.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -65.87 -25.63 67.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.176 1.39 . . . . 20.0 112.763 172.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -68.96 148.62 49.88 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.923 0.889 . . . . 20.0 111.089 -175.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.33 9.1 24.45 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.286 1.034 . . . . 20.0 113.272 -178.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.4 t -60.24 169.23 1.69 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.166 1.386 . . . . 20.0 112.011 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -146.39 114.57 6.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.696 1.998 . . . . 20.0 108.354 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -152.96 176.18 12.14 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.291 0.567 . . . . 20.0 112.129 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -58.05 140.45 52.49 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.839 1.656 . . . . 20.0 112.847 174.694 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -75.32 -9.9 58.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.363 1.865 . . . . 20.0 114.235 174.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.29 -71.91 0.28 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.968 0.907 . . . . 20.0 110.858 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' H ' HD12 ' A' ' 57' ' ' LEU . 3.8 mm-40 -65.97 -28.11 68.65 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.114 1.366 . . . . 20.0 113.056 -178.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -66.6 -41.51 88.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.351 0.5 . . . . 20.0 112.351 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.14 -19.74 63.2 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.733 0.813 . . . . 20.0 112.212 174.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.2 m -90.74 -17.27 26.98 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.386 1.474 . . . . 20.0 112.86 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.98 -45.27 74.63 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 125.058 1.343 . . . . 20.0 110.241 176.303 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 142.33 175.4 15.59 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.292 0.948 . . . . 20.0 113.035 170.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -79.54 73.89 6.21 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.918 1.287 . . . . 20.0 109.204 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 162.32 -18.1 0.16 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.042 1.306 . . . . 20.0 113.127 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -146.57 174.42 11.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.534 1.533 . . . . 20.0 112.288 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -157.06 162.94 39.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.011 1.724 . . . . 20.0 112.122 -171.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -69.05 153.06 44.41 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 118.213 0.461 . . . . 20.0 110.481 169.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.9 t -152.56 159.07 43.3 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.384 1.474 . . . . 20.0 109.886 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.4 t -145.92 160.15 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 127.104 2.161 . . . . 20.0 107.53 175.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 58.98 19.01 6.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.645 1.978 . . . . 20.0 114.508 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.71 119.08 8.59 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.32 1.848 . . . . 20.0 111.209 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 . . . . . 0 C--O 1.251 1.182 0 C-N-CA 124.321 1.049 . . . . 20.0 110.111 -177.636 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 109.289 -0.634 . . . . 20.0 109.289 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -67.75 -37.28 81.91 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.57 0.348 . . . . 20.0 111.318 -175.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.0 t -65.28 -41.4 94.21 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.337 1.455 . . . . 20.0 112.098 -177.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 73.4 t -77.0 -40.18 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 20.0 110.822 176.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.9 t -62.46 -36.27 81.93 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.781 1.232 . . . . 20.0 112.628 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -76.04 -6.43 51.03 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 20.0 113.341 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.37 25.4 21.42 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.799 -1.001 . . . . 20.0 113.977 171.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -111.13 174.62 5.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.542 1.137 . . . . 20.0 111.594 -177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.79 178.03 16.57 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.033 1.302 . . . . 20.0 113.063 -171.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.9 m -123.51 69.33 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.242 1.417 . . . . 20.0 109.96 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mp -71.82 155.47 92.12 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 124.715 1.206 . . . . 20.0 109.29 171.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -72.01 162.01 43.1 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.162 2.575 . . . . 20.0 110.632 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -65.08 -24.38 67.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.209 0.604 . . . . 20.0 112.14 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -63.11 -39.43 94.68 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.689 1.196 . . . . 20.0 112.016 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -96.86 -47.8 5.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.412 1.085 . . . . 20.0 111.768 -176.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.13 118.12 36.42 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.36 1.464 . . . . 20.0 110.771 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -70.06 158.0 57.97 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.736 2.291 . . . . 20.0 110.355 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -77.84 -9.95 59.31 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.296 1.039 . . . . 20.0 112.708 -167.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.88 -37.71 39.5 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.306 2.242 . . . . 20.0 112.014 172.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.21 -5.05 55.46 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.413 1.485 . . . . 20.0 113.85 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -74.71 100.86 4.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.877 0.871 . . . . 20.0 111.523 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.6 mt -70.88 175.46 5.05 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.594 1.958 . . . . 20.0 112.605 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.4 p -99.75 -6.45 27.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.481 1.112 . . . . 20.0 113.56 177.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -72.34 172.83 9.64 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.328 1.051 . . . . 20.0 111.91 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.88 170.66 22.38 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.075 1.322 . . . . 20.0 111.684 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.54 12.41 3.39 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.176 1.369 . . . . 20.0 113.881 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 89.8 m -108.47 176.28 5.17 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 125.473 1.509 . . . . 20.0 111.856 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.1 m -110.31 -4.0 15.9 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.768 1.227 . . . . 20.0 111.912 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 p -137.16 -72.19 0.43 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.069 1.748 . . . . 20.0 109.634 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -160.12 143.24 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 124.681 1.193 . . . . 20.0 110.23 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.4 m -73.57 129.29 37.66 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 124.573 1.149 . . . . 20.0 110.245 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.3 t -131.11 113.55 14.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.434 1.094 . . . . 20.0 110.901 -174.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -63.52 108.24 1.32 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.992 2.117 . . . . 20.0 110.921 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.2 mt -83.04 -18.97 37.84 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.77 1.228 . . . . 20.0 113.272 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.5 p -78.75 -12.1 60.01 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.634 0.976 . . . . 20.0 113.634 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.28 5.11 23.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.053 1.741 . . . . 20.0 112.813 171.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.8 tp -107.94 -42.3 4.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.23 1.812 . . . . 20.0 110.765 -175.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.2 t -152.09 174.74 13.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.527 1.531 . . . . 20.0 111.435 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.19 170.35 27.14 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 125.869 1.699 . . . . 20.0 114.158 168.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.0 m -71.67 -54.64 9.69 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.762 1.225 . . . . 20.0 110.895 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.1 tptt 48.13 29.0 1.67 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.028 2.531 . . . . 20.0 115.447 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.9 -110.56 3.76 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 126.095 1.807 . . . . 20.0 110.198 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 tttm 65.32 6.75 3.81 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 128.95 2.9 . . . . 20.0 114.459 -178.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.33 1.9 47.62 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.293 1.901 . . . . 20.0 112.916 -171.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.29 169.76 39.5 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 125.708 1.623 . . . . 20.0 114.201 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -153.54 -179.4 7.74 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.077 1.14 . . . . 20.0 114.077 -169.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.0 m -113.1 82.26 1.63 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.917 2.087 . . . . 20.0 109.981 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.8 165.88 29.94 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 125.204 1.402 . . . . 20.0 111.438 173.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -67.66 150.98 79.73 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.833 3.022 . . . . 20.0 112.807 -176.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.8 mt -63.96 -19.25 65.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.81 1.244 . . . . 20.0 112.409 171.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.34 -24.2 65.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.564 1.545 . . . . 20.0 111.928 174.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -84.71 128.35 34.56 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.282 1.033 . . . . 20.0 110.243 175.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -67.87 107.45 2.64 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.715 1.606 . . . . 20.0 111.276 -175.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.1 t -156.93 -170.26 3.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.273 1.829 . . . . 20.0 109.727 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -120.15 174.81 6.26 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.473 1.909 . . . . 20.0 109.995 175.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -136.27 161.38 35.92 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.505 1.522 . . . . 20.0 111.742 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -137.18 22.47 3.01 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.994 1.718 . . . . 20.0 114.439 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . 0.254 23.1 pt20 53.92 21.45 2.83 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 130.366 3.466 . . . . 20.0 116.912 166.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.75 -87.1 0.64 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.568 1.547 . . . . 20.0 109.977 -170.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -75.45 -27.05 58.76 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.577 0.626 . . . . 20.0 110.928 174.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.6 p -71.42 11.93 0.4 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.73 2.012 . . . . 20.0 113.877 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.04 -9.81 8.68 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.909 1.684 . . . . 20.0 112.775 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 t -86.33 -46.85 9.9 Favored 'General case' 0 C--N 1.345 0.395 0 C-N-CA 124.399 1.08 . . . . 20.0 113.122 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 5.0 m -66.54 -8.7 28.48 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.596 1.559 . . . . 20.0 115.083 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.27 164.76 33.17 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.755 1.645 . . . . 20.0 112.778 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -48.34 117.7 2.09 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.273 1.429 . . . . 20.0 112.087 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.07 8.4 11.66 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-O 118.248 -1.307 . . . . 20.0 113.009 -171.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.5 pm0 -105.36 153.49 21.58 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.467 1.634 . . . . 20.0 112.622 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 166.52 33.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.955 2.102 . . . . 20.0 109.486 162.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.6 t -128.09 133.69 49.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.072 0.949 . . . . 20.0 111.045 -175.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 82.6 m -133.81 77.89 1.74 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.331 1.452 . . . . 20.0 109.638 -168.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 39.9 t -135.62 96.9 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.901 0.881 . . . . 20.0 108.81 -172.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.97 -179.68 4.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.969 1.708 . . . . 20.0 110.779 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -120.2 176.31 5.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.886 1.674 . . . . 20.0 112.003 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.7 t60 . . . . . 0 C--O 1.252 1.229 0 CA-C-O 116.728 -1.606 . . . . 20.0 111.825 -177.944 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 . . . . . 0 N--CA 1.478 0.935 0 CA-C-O 120.303 0.097 . . . . 20.0 110.869 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 -122.32 -44.06 2.28 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.453 1.101 . . . . 20.0 111.472 -175.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.34 -56.33 23.51 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.964 1.306 . . . . 20.0 111.205 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.1 t -72.36 -28.25 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 125.643 1.577 . . . . 20.0 111.006 -178.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.3 t -66.72 -38.31 86.45 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.308 1.043 . . . . 20.0 111.685 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -75.05 -10.54 59.57 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.566 1.146 . . . . 20.0 112.886 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.71 1.16 62.01 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.841 1.21 . . . . 20.0 114.817 172.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -73.01 175.26 6.82 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.423 1.112 . . . . 20.0 111.561 175.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -106.32 166.91 13.97 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 124.873 1.225 . . . . 20.0 112.226 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -118.71 69.17 0.8 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.245 1.418 . . . . 20.0 109.202 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.18 156.18 90.9 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.99 1.316 . . . . 20.0 109.69 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.48 161.77 44.6 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.658 2.239 . . . . 20.0 111.215 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -63.54 -24.61 67.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.031 0.932 . . . . 20.0 112.148 177.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 p -65.99 -46.56 77.55 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.836 1.254 . . . . 20.0 111.982 173.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -80.77 -52.58 7.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.553 1.141 . . . . 20.0 111.558 -176.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.4 t -67.94 120.35 73.35 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.903 1.281 . . . . 20.0 110.657 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -69.31 161.49 45.66 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.316 2.677 . . . . 20.0 110.845 175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.71 -21.08 62.6 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.008 1.323 . . . . 20.0 112.696 -166.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.22 -39.46 59.98 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.877 2.471 . . . . 20.0 112.113 176.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.08 -5.21 55.48 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.083 1.353 . . . . 20.0 113.415 -177.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.98 102.39 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 124.291 1.036 . . . . 20.0 110.646 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.41 170.19 14.77 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.53 1.132 . . . . 20.0 111.983 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -91.91 -9.69 42.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.286 1.434 . . . . 20.0 112.698 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -71.41 159.88 33.75 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.693 1.197 . . . . 20.0 112.358 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -112.8 -179.5 19.49 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.7 1.619 . . . . 20.0 112.802 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.43 -5.75 41.4 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.382 1.467 . . . . 20.0 114.071 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.5 m -82.44 178.32 8.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.925 1.29 . . . . 20.0 112.524 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -114.57 -2.35 13.15 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.539 1.536 . . . . 20.0 111.649 175.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.8 p -138.64 -74.25 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.225 1.81 . . . . 20.0 109.841 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -166.74 143.61 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 126.526 1.93 . . . . 20.0 108.967 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.05 145.08 40.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.48 0.712 . . . . 20.0 110.265 173.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.09 118.66 14.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.854 0.861 . . . . 20.0 110.304 -176.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 93.13 0.33 Allowed 'General case' 0 C--N 1.346 0.417 0 C-N-CA 123.793 0.837 . . . . 20.0 111.665 178.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.31 -28.22 67.81 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.494 0.717 . . . . 20.0 111.65 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 t -78.38 -11.74 59.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.496 1.518 . . . . 20.0 113.226 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -132.17 8.14 4.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.806 1.242 . . . . 20.0 113.465 -176.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.18 -36.2 79.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.208 1.803 . . . . 20.0 112.093 -176.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 80.7 p -118.02 -37.92 3.31 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.645 1.578 . . . . 20.0 112.305 -173.088 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.38 -161.96 50.13 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.294 0.949 . . . . 20.0 113.213 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.2 t -62.97 -66.46 0.54 Allowed 'General case' 0 C--N 1.342 0.243 0 C-N-CA 124.297 1.039 . . . . 20.0 109.88 169.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 tttm 55.79 15.3 1.59 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.563 2.345 . . . . 20.0 114.84 -176.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.61 -32.19 7.49 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 126.955 2.217 . . . . 20.0 112.388 -176.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm 62.04 9.65 3.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.328 3.051 . . . . 20.0 114.736 172.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 6.96 66.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.029 1.776 . . . . 20.0 113.712 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.43 -161.05 4.36 Favored Glycine 0 C--N 1.343 0.947 0 C-N-CA 126.618 2.056 . . . . 20.0 114.021 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -130.53 171.45 13.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 122.95 0.5 . . . . 20.0 112.272 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.2 t -98.57 107.58 20.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.96 0.904 . . . . 20.0 110.421 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -137.21 156.51 75.38 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.878 2.471 . . . . 20.0 109.518 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.69 164.69 30.29 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.593 2.862 . . . . 20.0 113.494 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 69' ' ' LYS . 91.4 mt -61.55 -21.14 64.01 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.682 1.593 . . . . 20.0 112.702 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -98.8 9.9 42.41 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.843 1.657 . . . . 20.0 113.337 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.4 tpt85 -74.78 33.13 0.09 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.442 1.897 . . . . 20.0 112.985 175.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.28 -8.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 129.568 3.147 . . . . 20.0 114.459 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 59.3 m -74.29 148.84 41.07 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.554 1.542 . . . . 20.0 111.274 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -150.26 116.25 5.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.352 1.461 . . . . 20.0 110.493 173.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 5.3 tp10 -160.26 -173.97 4.29 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.328 1.451 . . . . 20.0 109.97 178.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.448 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.0 pp -56.94 158.47 4.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.252 1.821 . . . . 20.0 113.061 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -121.17 -0.52 9.93 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.931 2.092 . . . . 20.0 113.692 174.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.92 -9.56 39.48 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.748 1.619 . . . . 20.0 114.623 176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -135.07 -42.66 0.73 Allowed 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.208 1.403 . . . . 20.0 111.44 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.2 p -63.43 -16.45 60.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.356 1.462 . . . . 20.0 113.907 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.81 -2.3 0.53 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.011 2.124 . . . . 20.0 114.009 171.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m -56.97 -39.73 75.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.2 1.8 . . . . 20.0 112.748 172.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.5 t -76.46 -15.76 59.83 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 119.058 0.845 . . . . 20.0 112.684 173.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.45 -175.54 21.88 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 126.099 1.809 . . . . 20.0 111.365 -171.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -65.47 99.86 0.45 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.567 1.547 . . . . 20.0 109.642 175.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.07 -24.85 0.61 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.182 1.372 . . . . 20.0 112.832 -175.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -105.08 138.51 41.17 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.993 1.397 . . . . 20.0 111.672 -175.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD2' ' HA ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -133.48 138.64 46.25 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.838 2.455 . . . . 20.0 110.746 175.682 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.0 t -55.6 110.76 0.76 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.544 1.138 . . . . 20.0 111.428 -177.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.9 t -138.92 72.38 1.4 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 123.415 0.686 . . . . 20.0 112.348 -169.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 45.8 t -141.47 113.89 4.12 Favored 'Isoleucine or valine' 0 C--N 1.338 0.1 0 C-N-CA 124.749 1.22 . . . . 20.0 109.42 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -79.27 -8.46 59.06 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.711 1.604 . . . . 20.0 113.869 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.4 tp -82.38 160.12 22.86 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.896 2.078 . . . . 20.0 110.37 177.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.3 t60 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.314 2.245 . . . . 20.0 112.518 174.811 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 119.424 -0.322 . . . . 20.0 110.802 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 79.8 m -65.25 -26.2 68.0 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.631 1.173 . . . . 20.0 112.996 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.1 t -65.02 -52.77 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.057 1.343 . . . . 20.0 109.905 167.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 t -63.28 -30.84 71.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.866 1.266 . . . . 20.0 112.94 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.66 -31.22 21.19 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.782 1.233 . . . . 20.0 111.942 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.25 58.88 1.19 Allowed Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.202 1.382 . . . . 20.0 113.324 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -127.44 -178.76 4.58 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.001 2.12 . . . . 20.0 111.25 174.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.91 178.83 32.4 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.27 1.414 . . . . 20.0 113.037 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.5 m -128.37 30.3 5.2 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.545 1.938 . . . . 20.0 112.239 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.6 148.11 67.67 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.111 0.965 . . . . 20.0 110.825 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.93 164.08 36.8 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.136 2.557 . . . . 20.0 111.841 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -60.07 -29.6 68.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.059 1.743 . . . . 20.0 112.221 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.0 m -72.71 -35.19 67.53 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.179 0.992 . . . . 20.0 112.602 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -81.21 -65.65 0.99 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.14 0.976 . . . . 20.0 110.405 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 m -70.51 154.3 94.5 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 123.697 0.799 . . . . 20.0 111.359 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.24 173.39 14.59 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.694 2.929 . . . . 20.0 111.719 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.42 -18.56 61.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.065 1.346 . . . . 20.0 113.037 -174.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -90.7 -36.54 14.27 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.958 2.103 . . . . 20.0 112.877 -175.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.45 -9.74 57.27 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.505 1.522 . . . . 20.0 113.658 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.12 101.46 1.44 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.661 1.585 . . . . 20.0 110.702 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -72.22 164.02 26.96 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.672 1.189 . . . . 20.0 111.106 175.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.9 m -94.39 -11.35 30.08 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.084 1.353 . . . . 20.0 113.172 -175.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.436 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 24.1 m-85 -64.88 168.58 6.15 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.67 1.988 . . . . 20.0 112.278 177.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -123.89 -178.6 15.46 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.889 1.233 . . . . 20.0 113.935 -175.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.93 -16.47 54.3 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.833 2.159 . . . . 20.0 114.444 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.1 m -73.07 -178.63 2.92 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.778 1.231 . . . . 20.0 112.65 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -94.7 -18.0 21.71 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.676 0.79 . . . . 20.0 111.958 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 p -142.1 -73.02 0.31 Allowed 'General case' 0 C--N 1.34 0.177 0 C-N-CA 125.455 1.502 . . . . 20.0 109.454 -173.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.51 148.64 11.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.574 1.549 . . . . 20.0 108.208 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.9 m -84.62 145.68 27.89 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.735 0.414 . . . . 20.0 110.217 173.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 45.2 t -134.49 120.87 20.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.557 1.143 . . . . 20.0 110.124 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.34 88.43 0.64 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.69 1.196 . . . . 20.0 112.747 -178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.5 mt -66.1 -22.14 66.39 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.555 1.142 . . . . 20.0 112.571 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.1 m -65.68 -22.08 66.6 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 125.812 1.645 . . . . 20.0 112.6 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.8 mttm . . . . . 0 CA--C 1.533 0.324 0 C-N-CA 125.595 1.558 . . . . 20.0 112.569 -170.026 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm . . . . . 0 CA--C 1.535 0.368 0 CA-C-O 118.589 -0.72 . . . . 20.0 112.692 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 141.77 -38.71 1.47 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 124.338 0.971 . . . . 20.0 112.365 167.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 170.64 46.66 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.333 0.968 . . . . 20.0 113.797 171.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -153.59 129.09 9.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.925 1.29 . . . . 20.0 110.369 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.6 m -87.99 128.75 35.39 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.362 1.065 . . . . 20.0 109.121 162.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.35 159.15 73.0 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 126.016 1.727 . . . . 20.0 109.124 168.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.15 160.3 38.94 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.841 3.027 . . . . 20.0 112.723 -170.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.32 -20.64 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.243 1.017 . . . . 20.0 112.362 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -28.29 65.52 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.917 1.687 . . . . 20.0 111.772 175.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.9 ttm-85 -99.45 111.64 23.96 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.448 1.099 . . . . 20.0 110.04 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -73.98 116.31 14.46 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.331 1.453 . . . . 20.0 109.346 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 45.8 t -144.59 -91.54 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.666 1.187 . . . . 20.0 110.276 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.431 ' HE3' ' HA ' ' A' ' 71' ' ' CYS . 22.2 ttpp -154.06 158.24 40.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.229 1.812 . . . . 20.0 109.646 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -131.68 133.08 44.49 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.841 1.256 . . . . 20.0 110.278 -176.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 tp -159.18 103.59 1.65 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.013 1.325 . . . . 20.0 110.144 -171.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -66.27 -6.69 14.73 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.96 1.704 . . . . 20.0 115.061 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.95 78.99 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.324 1.05 . . . . 20.0 113.473 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -137.24 -49.42 0.61 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.282 1.033 . . . . 20.0 111.337 -169.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.5 p -67.82 -10.23 51.12 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.106 1.151 . . . . 20.0 114.106 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.44 -20.57 46.04 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.617 1.339 . . . . 20.0 114.617 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 90.7 p -125.13 34.59 4.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.836 1.254 . . . . 20.0 112.135 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.4 -13.8 59.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.633 0.975 . . . . 20.0 113.633 174.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.15 -103.23 0.89 Allowed Glycine 0 C--N 1.343 0.958 0 C-N-CA 125.349 1.452 . . . . 20.0 110.573 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -70.31 93.72 0.88 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.244 1.417 . . . . 20.0 109.474 173.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.88 60.18 1.09 Allowed Glycine 0 C--N 1.337 0.617 0 C-N-CA 124.502 1.049 . . . . 20.0 112.614 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -75.1 36.4 0.11 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.935 2.494 . . . . 20.0 114.858 177.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -119.75 99.46 6.66 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.664 1.986 . . . . 20.0 111.703 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.31 125.75 28.53 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.443 1.497 . . . . 20.0 110.962 173.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.431 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 80.5 m -127.5 135.66 50.68 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.828 1.651 . . . . 20.0 109.867 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 CA--C 1.536 0.405 0 C-N-CA 124.886 1.274 . . . . 20.0 108.993 175.636 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 112.58 0.585 . . . . 20.0 112.58 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.0 m -53.58 -59.86 4.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.9 1.68 . . . . 20.0 110.946 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.8 t -64.3 -34.26 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 125.699 1.6 . . . . 20.0 111.387 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -68.78 -16.96 63.95 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.901 1.28 . . . . 20.0 112.925 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -102.29 -7.71 21.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.121 1.768 . . . . 20.0 112.139 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.7 0.08 52.61 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.335 1.922 . . . . 20.0 114.133 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -86.32 177.09 7.58 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.042 1.737 . . . . 20.0 111.131 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.97 -176.54 16.42 Favored Glycine 0 C--N 1.341 0.81 0 C-N-CA 124.851 1.215 . . . . 20.0 113.229 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.31 76.57 1.73 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.795 1.638 . . . . 20.0 109.304 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.09 162.02 75.81 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 125.103 1.361 . . . . 20.0 109.627 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.23 161.76 44.82 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.48 2.12 . . . . 20.0 110.457 170.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.73 -26.92 68.93 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.964 0.906 . . . . 20.0 111.469 171.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.4 m -69.73 -16.31 63.3 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.045 1.338 . . . . 20.0 113.582 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -122.34 -41.83 2.39 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.828 1.251 . . . . 20.0 111.825 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.6 t -67.63 119.46 66.11 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 123.878 0.871 . . . . 20.0 109.883 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.91 163.14 38.66 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.175 2.583 . . . . 20.0 111.276 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -72.32 -3.56 24.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.788 1.635 . . . . 20.0 113.268 -170.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -100.27 -36.51 9.25 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.248 2.619 . . . . 20.0 111.846 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.51 -13.6 59.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.167 1.387 . . . . 20.0 113.589 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -67.02 120.87 14.37 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.888 1.275 . . . . 20.0 110.852 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.4 mt -86.81 178.83 6.88 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.855 1.262 . . . . 20.0 110.829 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -102.22 -1.31 31.53 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.242 1.417 . . . . 20.0 112.688 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -68.02 174.9 3.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.968 1.707 . . . . 20.0 113.398 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.24 -176.77 14.57 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.92 1.724 . . . . 20.0 112.812 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.89 -11.79 59.08 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 126.148 1.832 . . . . 20.0 113.422 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 71.2 m -74.0 175.86 7.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.504 1.152 . . . . 20.0 112.78 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.7 m -106.27 -14.72 15.04 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.917 1.287 . . . . 20.0 111.938 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.2 p -138.01 -69.71 0.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.046 1.738 . . . . 20.0 109.985 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -157.12 156.11 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 125.35 1.46 . . . . 20.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -79.47 161.46 26.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.979 0.912 . . . . 20.0 110.338 171.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -151.35 117.56 5.61 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.638 0.775 . . . . 20.0 110.793 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -70.75 98.77 1.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.643 1.577 . . . . 20.0 110.405 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.3 mt -79.59 -16.46 55.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.402 1.081 . . . . 20.0 113.19 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -71.11 -33.19 69.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.37 1.068 . . . . 20.0 111.455 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 125.117 1.367 . . . . 20.0 112.959 177.691 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 112.576 0.584 . . . . 20.0 112.576 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 166.77 -35.2 0.23 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.617 1.103 . . . . 20.0 112.944 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.13 166.84 15.09 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 125.248 1.404 . . . . 20.0 113.99 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -151.03 167.49 27.5 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.767 1.227 . . . . 20.0 112.68 -172.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.8 m -87.23 66.14 9.1 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.421 1.488 . . . . 20.0 110.848 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.75 158.45 87.77 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.252 1.021 . . . . 20.0 111.177 172.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.86 156.22 66.78 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 124.066 3.177 . . . . 20.0 112.092 -173.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.16 -20.63 65.58 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 20.0 113.083 173.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.47 -15.16 62.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.714 1.606 . . . . 20.0 112.872 175.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.405 HH11 ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -80.9 139.8 35.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 20.0 110.201 178.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -80.5 101.83 9.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.796 -0.816 . . . . 20.0 108.796 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.416 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -156.9 175.49 14.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.07 1.348 . . . . 20.0 109.995 179.55 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -76.91 159.12 30.26 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.697 0.799 . . . . 20.0 109.715 170.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -125.18 144.15 50.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.603 1.161 . . . . 20.0 110.117 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.6 170.71 14.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.403 2.281 . . . . 20.0 110.19 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -104.02 -4.07 23.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.059 1.744 . . . . 20.0 110.812 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.37 -82.46 0.08 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.101 1.76 . . . . 20.0 111.564 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.2 -32.68 61.28 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.135 1.374 . . . . 20.0 112.542 -173.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.94 -25.04 67.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.511 1.124 . . . . 20.0 111.934 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.51 -19.82 63.72 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.355 1.062 . . . . 20.0 113.663 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.8 m -66.53 -56.19 11.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.992 1.317 . . . . 20.0 110.269 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 83.1 m -70.83 -21.79 62.4 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.859 0.864 . . . . 20.0 112.01 173.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.47 -94.06 1.67 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.945 2.212 . . . . 20.0 112.736 172.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -138.48 164.04 30.4 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.782 1.633 . . . . 20.0 111.754 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.57 -16.82 59.93 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.926 1.251 . . . . 20.0 112.783 -170.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 178.5 4.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.988 1.715 . . . . 20.0 112.417 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -150.32 156.21 41.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.579 2.751 . . . . 20.0 108.697 169.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 37.4 t -73.97 133.04 42.98 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.597 -0.52 . . . . 20.0 109.597 172.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.6 t -156.06 163.32 39.82 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.666 1.187 . . . . 20.0 110.351 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 124.906 1.283 . . . . 20.0 110.588 176.526 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 . . . . . 0 CA--C 1.535 0.388 0 N-CA-C 112.036 0.384 . . . . 20.0 112.036 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.75 -36.7 83.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.079 0.952 . . . . 20.0 111.983 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.3 t -68.44 -43.3 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.894 1.278 . . . . 20.0 110.513 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.0 m -62.57 -42.82 99.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.175 0.99 . . . . 20.0 111.967 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -66.13 -22.08 66.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.775 1.23 . . . . 20.0 112.663 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.0 3.34 55.87 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.513 1.53 . . . . 20.0 114.597 176.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.91 -179.53 3.23 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.425 1.49 . . . . 20.0 111.684 174.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.6 171.91 13.98 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.955 1.264 . . . . 20.0 113.382 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.08 63.38 0.79 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.715 1.606 . . . . 20.0 110.071 176.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.03 156.21 92.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 124.522 1.129 . . . . 20.0 109.874 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.21 160.67 48.75 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.663 2.242 . . . . 20.0 110.6 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -63.59 -23.15 67.27 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.078 0.951 . . . . 20.0 111.385 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.3 t -59.87 -57.02 14.67 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.016 1.327 . . . . 20.0 111.039 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -85.58 -45.64 11.56 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.589 0.756 . . . . 20.0 111.436 -169.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -65.07 124.27 86.3 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.165 0.986 . . . . 20.0 110.416 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -69.09 161.58 45.26 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.915 2.41 . . . . 20.0 110.776 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -77.75 -0.46 27.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.934 1.294 . . . . 20.0 113.65 -169.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -102.79 -35.23 8.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.25 2.22 . . . . 20.0 112.521 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.95 -12.77 61.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.477 1.111 . . . . 20.0 113.638 175.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -66.99 121.21 15.05 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 124.773 1.229 . . . . 20.0 110.508 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.3 mt -84.26 169.74 14.41 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.803 1.241 . . . . 20.0 112.569 -176.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.6 p -84.36 -16.54 42.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 20.0 112.627 175.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -73.91 172.58 11.33 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.703 2.001 . . . . 20.0 111.809 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.78 -179.15 15.95 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.734 1.635 . . . . 20.0 111.775 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.23 25.18 1.69 Allowed Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.378 0.99 . . . . 20.0 113.845 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.6 m -128.29 -179.77 5.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.671 1.588 . . . . 20.0 111.8 -173.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.6 m -104.5 -11.78 16.84 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.749 0.819 . . . . 20.0 112.215 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.3 p -138.4 -66.81 0.48 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.922 1.289 . . . . 20.0 109.807 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.0 155.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.251 1.82 . . . . 20.0 108.934 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.8 m -82.65 160.1 22.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.035 0.534 . . . . 20.0 110.701 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 t -147.16 119.08 8.13 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.368 0.667 . . . . 20.0 110.051 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -69.75 99.32 1.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.237 1.415 . . . . 20.0 110.262 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 mt -77.23 -13.55 59.92 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.249 1.02 . . . . 20.0 112.663 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.7 t -85.02 -16.11 41.87 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.647 1.579 . . . . 20.0 113.218 -177.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.4 pttp . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 124.88 1.272 . . . . 20.0 113.212 175.001 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 113.218 0.821 . . . . 20.0 113.218 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.54 35.39 0.65 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.196 1.379 . . . . 20.0 111.912 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.16 157.47 27.68 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.139 1.352 . . . . 20.0 113.637 -173.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -146.32 155.84 42.92 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.894 1.278 . . . . 20.0 109.822 -175.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 18.8 t -106.55 111.91 24.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.794 1.638 . . . . 20.0 109.135 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 71' ' ' CYS . 5.0 p30 -141.48 156.33 66.91 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 127.305 2.242 . . . . 20.0 110.291 -167.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.23 161.25 34.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.226 2.617 . . . . 20.0 113.497 -170.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.07 -18.43 65.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.808 0.843 . . . . 20.0 112.238 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -66.85 -22.39 65.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.066 1.747 . . . . 20.0 112.041 172.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.38 122.95 26.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.56 1.544 . . . . 20.0 109.138 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -69.93 104.06 2.41 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.587 1.155 . . . . 20.0 110.574 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 t -159.82 175.75 12.73 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.388 1.475 . . . . 20.0 110.296 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -78.38 141.38 38.41 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.672 1.189 . . . . 20.0 109.372 171.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.84 133.24 49.16 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.121 1.368 . . . . 20.0 109.172 173.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.22 122.16 23.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.393 1.877 . . . . 20.0 111.041 -170.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -64.43 -15.96 61.55 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.748 1.619 . . . . 20.0 114.129 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.47 63.91 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.268 1.427 . . . . 20.0 113.793 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -139.17 -37.68 0.51 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.672 1.189 . . . . 20.0 112.518 -168.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.8 t -64.42 -29.39 70.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.5 1.12 . . . . 20.0 112.447 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.62 72.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.581 0.752 . . . . 20.0 111.711 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.0 m -79.58 -33.14 41.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.045 1.338 . . . . 20.0 111.972 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.7 m -63.87 -34.02 77.01 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.388 1.075 . . . . 20.0 111.47 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.68 170.84 47.25 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 125.728 1.632 . . . . 20.0 112.796 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 126.24 26.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.648 1.179 . . . . 20.0 111.627 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 114.23 -19.68 17.19 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.689 1.614 . . . . 20.0 113.298 -178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -138.44 177.32 7.97 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.222 1.809 . . . . 20.0 111.98 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -151.31 173.37 14.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.827 2.051 . . . . 20.0 111.492 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.0 t -91.5 147.17 23.21 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.067 0.547 . . . . 20.0 109.779 163.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.411 ' HB3' HD21 ' A' ' 48' ' ' ASN . 49.9 t -144.0 161.17 39.45 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.758 1.223 . . . . 20.0 109.936 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.2 t . . . . . 0 CA--C 1.537 0.464 0 C-N-CA 126.251 1.821 . . . . 20.0 109.033 -179.309 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 CA--C 1.532 0.287 0 N-CA-C 112.035 0.383 . . . . 20.0 112.035 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.32 -36.27 81.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.373 1.069 . . . . 20.0 111.97 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 63.0 t -76.71 -41.99 33.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.49 1.516 . . . . 20.0 110.776 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 t -61.59 -44.16 97.53 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.182 1.393 . . . . 20.0 111.976 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -68.25 -12.97 61.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.469 1.508 . . . . 20.0 113.164 176.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.43 1.28 56.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.145 1.355 . . . . 20.0 114.603 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -74.71 175.17 8.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.57 1.185 . . . . 20.0 112.09 -178.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -103.6 175.9 23.77 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.014 1.292 . . . . 20.0 112.399 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -132.77 65.77 1.58 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.599 1.559 . . . . 20.0 109.42 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.94 158.12 87.65 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.135 0.974 . . . . 20.0 110.028 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.34 165.49 30.32 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.183 2.589 . . . . 20.0 111.389 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -60.92 -32.47 71.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.205 0.602 . . . . 20.0 111.374 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -65.66 -45.69 82.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.096 0.958 . . . . 20.0 112.162 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.61 -49.85 10.73 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.024 0.93 . . . . 20.0 111.725 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -67.64 124.94 90.52 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.193 0.997 . . . . 20.0 110.574 -179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.74 160.78 48.17 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.802 2.335 . . . . 20.0 110.25 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -73.09 -18.49 61.3 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.732 0.813 . . . . 20.0 112.735 -170.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.4 -41.17 33.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.98 2.112 . . . . 20.0 112.365 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -9.02 58.2 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.69 1.196 . . . . 20.0 113.488 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -70.5 113.7 7.88 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.518 1.127 . . . . 20.0 110.748 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 37.4 mt -84.88 170.74 12.82 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.187 1.395 . . . . 20.0 111.957 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 98.0 p -82.44 -13.64 56.43 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.337 1.055 . . . . 20.0 113.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -74.76 175.25 8.14 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.804 1.241 . . . . 20.0 112.591 -175.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -137.14 -176.93 14.66 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.35 1.452 . . . . 20.0 112.317 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.46 -4.73 33.04 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.508 1.528 . . . . 20.0 113.332 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.8 m -78.9 176.33 9.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.663 1.185 . . . . 20.0 111.984 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.8 t -111.54 -6.86 14.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.238 1.415 . . . . 20.0 111.579 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.6 p -131.6 -75.42 0.52 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.165 1.786 . . . . 20.0 109.021 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.2 p -165.58 151.89 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 126.852 2.061 . . . . 20.0 108.358 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.6 m -67.8 154.71 40.95 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.388 0.675 . . . . 20.0 111.497 172.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.3 t -151.06 113.69 4.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.589 0.755 . . . . 20.0 110.132 174.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -69.57 102.72 1.9 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.96 0.904 . . . . 20.0 110.165 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 mt -68.7 -22.28 64.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.189 0.996 . . . . 20.0 111.941 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 t -82.9 -7.0 59.7 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.823 1.649 . . . . 20.0 112.884 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt . . . . . 0 N--CA 1.472 0.658 0 C-N-CA 125.243 1.417 . . . . 20.0 112.803 179.116 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.6 mmtm . . . . . 0 N--CA 1.466 0.358 0 N-CA-C 113.434 0.901 . . . . 20.0 113.434 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.34 31.94 2.48 Favored Glycine 0 CA--C 1.532 1.138 0 CA-C-O 118.847 -0.974 . . . . 20.0 112.538 -170.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.67 179.41 20.17 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.714 1.626 . . . . 20.0 112.21 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -119.88 166.57 13.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.163 1.385 . . . . 20.0 112.323 -171.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 49.2 m -90.84 -43.14 10.23 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.268 1.027 . . . . 20.0 113.758 -173.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.68 171.03 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.217 2.207 . . . . 20.0 114.537 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.85 149.58 66.48 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.261 1.974 . . . . 20.0 110.713 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.58 -24.23 65.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.001 1.32 . . . . 20.0 113.076 177.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -78.11 -8.44 58.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.978 1.711 . . . . 20.0 113.076 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 164.73 26.0 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.587 1.155 . . . . 20.0 110.374 170.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -107.56 104.15 13.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.533 1.533 . . . . 20.0 109.265 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -158.78 167.67 28.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.957 1.703 . . . . 20.0 110.602 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.55 160.45 31.46 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.889 1.275 . . . . 20.0 111.818 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -133.22 114.26 13.61 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 126.247 1.819 . . . . 20.0 109.494 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pp -136.29 103.38 5.28 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.955 1.702 . . . . 20.0 110.235 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -61.26 -12.16 12.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.635 1.974 . . . . 20.0 113.564 -173.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.67 95.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.796 1.638 . . . . 20.0 113.325 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -119.74 -40.39 2.76 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.897 1.279 . . . . 20.0 111.429 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.3 p -70.52 -15.22 62.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.544 1.138 . . . . 20.0 113.911 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.8 18.65 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.534 1.309 . . . . 20.0 114.534 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 59.7 p -112.73 17.86 18.74 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.894 1.678 . . . . 20.0 113.572 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.8 m -67.27 -83.41 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.66 1.184 . . . . 20.0 111.286 174.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.2 -28.84 9.29 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.143 1.354 . . . . 20.0 114.399 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -136.11 35.84 2.8 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.303 1.441 . . . . 20.0 112.805 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -166.69 -45.86 0.02 OUTLIER Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.159 -0.801 . . . . 20.0 113.59 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.55 25.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 129.003 2.921 . . . . 20.0 117.017 -172.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.07 129.42 46.61 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 126.949 2.1 . . . . 20.0 108.749 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.2 t -110.38 127.92 55.32 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.989 0.916 . . . . 20.0 109.279 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.7 t -129.59 120.85 25.97 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.113 1.365 . . . . 20.0 108.855 -174.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.2 t . . . . . 0 CA--C 1.531 0.216 0 C-N-CA 124.974 1.309 . . . . 20.0 108.092 -171.8 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 119.289 -0.386 . . . . 20.0 111.768 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 33.2 m -63.91 -39.1 93.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.915 -0.565 . . . . 20.0 111.431 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.0 t -66.89 -35.4 74.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.192 0.997 . . . . 20.0 111.132 174.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -65.61 -35.46 80.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.139 0.976 . . . . 20.0 112.106 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.55 -28.06 41.25 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.592 1.157 . . . . 20.0 112.326 176.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.75 -1.32 32.06 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.408 1.48 . . . . 20.0 114.126 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -70.22 176.67 3.73 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.387 1.475 . . . . 20.0 111.588 172.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.96 179.13 20.5 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 125.263 1.411 . . . . 20.0 113.234 -175.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.9 m -132.56 54.43 1.95 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.153 1.781 . . . . 20.0 110.423 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.57 159.92 64.12 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.367 1.467 . . . . 20.0 111.276 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -68.92 158.31 58.42 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.463 2.109 . . . . 20.0 110.931 171.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.13 -24.65 67.77 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.451 1.1 . . . . 20.0 111.589 176.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.7 m -72.62 -19.53 61.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.222 1.409 . . . . 20.0 113.458 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -107.12 -54.34 2.49 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.758 1.223 . . . . 20.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.92 120.55 67.55 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.603 1.161 . . . . 20.0 110.259 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -68.46 165.55 28.68 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.977 2.451 . . . . 20.0 110.735 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -71.16 -14.62 62.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.904 0.882 . . . . 20.0 113.129 -170.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -85.18 -40.7 16.4 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.499 2.32 . . . . 20.0 112.432 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.06 -7.16 52.92 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.634 1.574 . . . . 20.0 113.613 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.57 107.68 5.21 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.458 1.503 . . . . 20.0 110.961 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -72.57 168.32 18.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.004 1.322 . . . . 20.0 112.139 177.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -89.48 -13.94 36.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.43 1.492 . . . . 20.0 112.75 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.43 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 27.6 m-85 -66.25 172.31 4.01 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.103 2.161 . . . . 20.0 111.992 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -138.97 -175.83 14.25 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.683 1.135 . . . . 20.0 113.18 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.4 -11.29 56.74 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.115 1.817 . . . . 20.0 113.632 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.3 m -69.7 175.09 4.45 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.58 1.152 . . . . 20.0 112.782 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.5 p -100.06 -14.52 18.58 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.656 1.583 . . . . 20.0 111.84 -176.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 p -141.6 -72.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.917 2.087 . . . . 20.0 109.156 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -159.05 154.02 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.481 1.512 . . . . 20.0 108.703 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 67.9 m -72.45 161.15 31.19 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.883 0.473 . . . . 20.0 111.711 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.3 120.86 6.92 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.163 0.985 . . . . 20.0 109.988 171.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -70.24 92.84 0.8 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 20.0 111.827 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.8 -37.07 86.38 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.496 1.119 . . . . 20.0 112.182 -174.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.1 t -63.04 -31.61 72.79 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.494 1.118 . . . . 20.0 111.95 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp . . . . . 0 CA--C 1.534 0.363 0 C-N-CA 124.429 1.091 . . . . 20.0 113.396 -176.897 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mptt . . . . . 0 CA--C 1.536 0.43 0 CA-C-O 119.218 -0.42 . . . . 20.0 112.008 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 86.0 -26.25 6.24 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.475 1.988 . . . . 20.0 112.907 -172.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.17 -171.3 48.83 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.175 1.369 . . . . 20.0 114.066 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.3 176.58 7.83 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.447 1.499 . . . . 20.0 112.002 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.0 t -108.46 101.48 10.65 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.007 1.323 . . . . 20.0 110.15 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -130.32 154.64 81.52 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 128.352 2.661 . . . . 20.0 110.945 -170.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.83 162.1 41.08 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.159 2.572 . . . . 20.0 113.221 -170.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.416 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 83.8 mt -66.39 -20.9 66.19 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.138 0.575 . . . . 20.0 112.142 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -69.37 -20.06 63.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.814 1.646 . . . . 20.0 112.391 174.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -68.46 144.59 54.61 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.371 1.068 . . . . 20.0 109.286 171.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -90.1 100.82 13.57 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.306 0.642 . . . . 20.0 109.797 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.39 176.73 9.54 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.737 1.615 . . . . 20.0 111.014 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -117.44 109.94 17.38 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.038 1.335 . . . . 20.0 111.138 -171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HA ' ' H ' ' A' ' 70' ' ' CYS . 1.8 pm0 -64.84 173.31 2.34 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.271 2.229 . . . . 20.0 114.507 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.1 mt -147.41 129.87 15.83 Favored 'General case' 0 C--N 1.347 0.462 0 C-N-CA 126.578 1.951 . . . . 20.0 109.847 167.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -64.29 -12.49 42.09 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.505 0.928 . . . . 20.0 113.505 166.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.86 -70.86 0.43 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.408 1.483 . . . . 20.0 110.969 167.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -85.31 -49.63 8.01 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.07 0.948 . . . . 20.0 112.865 -166.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 p -70.17 -7.01 38.41 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.615 1.166 . . . . 20.0 113.398 -174.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.79 -14.3 62.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.31 1.444 . . . . 20.0 113.663 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.9 t -64.8 -54.83 24.95 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.843 1.257 . . . . 20.0 112.584 -175.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.7 m -74.37 -15.44 60.93 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 118.709 -0.663 . . . . 20.0 112.322 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.39 -154.73 35.08 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-N 119.382 0.992 . . . . 20.0 112.925 175.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -60.19 110.34 1.2 Allowed 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.224 1.41 . . . . 20.0 110.602 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 124.59 -0.1 8.59 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.517 1.532 . . . . 20.0 113.325 -175.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -119.96 149.1 42.67 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.567 1.547 . . . . 20.0 111.596 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 17.2 ptpt -141.34 151.23 43.39 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.779 2.031 . . . . 20.0 109.461 165.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.471 ' H ' ' HA ' ' A' ' 56' ' ' GLU . 8.5 t -63.67 132.28 50.61 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.369 -0.604 . . . . 20.0 109.369 172.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.3 t -157.17 115.09 3.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.778 0.831 . . . . 20.0 110.37 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p . . . . . 0 CA--C 1.539 0.526 0 C-N-CA 124.617 1.167 . . . . 20.0 111.029 170.421 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 . . . . . 0 N--CA 1.465 0.294 0 CA-C-O 119.239 -0.41 . . . . 20.0 110.827 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 39.1 m -64.28 -36.63 84.72 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.879 1.272 . . . . 20.0 112.876 -172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.8 t -65.6 -46.03 90.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.186 1.394 . . . . 20.0 110.815 174.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 -40.87 98.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.736 1.614 . . . . 20.0 112.828 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -69.96 -27.78 65.01 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.823 1.649 . . . . 20.0 112.924 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.15 41.72 2.96 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.586 -1.119 . . . . 20.0 113.61 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -120.86 175.27 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.519 1.528 . . . . 20.0 111.72 176.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 171.51 26.68 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 124.913 1.245 . . . . 20.0 113.678 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.8 m -126.77 39.95 3.82 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.052 1.741 . . . . 20.0 111.318 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.74 153.84 20.44 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 20.0 110.934 175.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.45 155.97 65.47 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.618 2.212 . . . . 20.0 111.358 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.64 -20.25 66.17 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.776 1.231 . . . . 20.0 111.696 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -76.16 -8.69 57.59 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.825 1.65 . . . . 20.0 113.224 173.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -118.21 -66.65 1.06 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.618 1.567 . . . . 20.0 110.542 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.24 147.54 98.84 Favored Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 118.299 0.5 . . . . 20.0 112.04 -174.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.11 167.24 27.86 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.525 2.817 . . . . 20.0 111.147 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.52 9.99 8.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.973 1.709 . . . . 20.0 113.236 -170.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -121.45 -34.78 3.38 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 126.52 1.928 . . . . 20.0 113.193 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.04 -7.81 44.16 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.291 1.436 . . . . 20.0 112.973 173.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.03 108.29 4.52 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.611 1.564 . . . . 20.0 111.614 -175.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.8 mt -72.35 169.82 15.49 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.085 1.754 . . . . 20.0 112.797 -176.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.3 p -86.55 -17.71 33.35 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.152 1.381 . . . . 20.0 112.927 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -71.78 171.92 10.76 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.518 1.927 . . . . 20.0 111.913 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.99 149.71 19.64 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 125.313 1.435 . . . . 20.0 110.313 169.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 156.26 23.42 0.03 OUTLIER Glycine 0 CA--C 1.531 1.056 0 CA-C-O 118.633 -1.093 . . . . 20.0 114.004 -176.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.8 m -135.91 176.88 8.28 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.426 1.49 . . . . 20.0 112.115 -172.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -89.4 -19.59 25.0 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.461 1.104 . . . . 20.0 112.302 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -142.37 -66.39 0.39 Allowed 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.19 1.396 . . . . 20.0 110.747 -168.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.87 141.19 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.926 1.29 . . . . 20.0 109.466 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.4 m -78.64 104.44 9.25 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.625 1.17 . . . . 20.0 109.604 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.9 t -100.56 117.2 34.21 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.226 1.01 . . . . 20.0 110.819 -177.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -66.71 99.68 0.63 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.079 1.752 . . . . 20.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.0 mt -74.49 -18.27 60.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.367 1.067 . . . . 20.0 112.943 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.4 t -72.37 -21.68 61.25 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.268 1.027 . . . . 20.0 112.822 -176.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 126.031 1.732 . . . . 20.0 113.58 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.7 mttm . . . . . 0 CA--C 1.538 0.505 0 CA-C-O 119.399 -0.334 . . . . 20.0 111.893 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.2 -7.91 32.89 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.662 2.077 . . . . 20.0 113.066 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.74 156.66 6.22 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.618 1.58 . . . . 20.0 112.531 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -92.41 140.19 29.83 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.038 0.935 . . . . 20.0 110.281 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.94 8.67 22.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.851 1.66 . . . . 20.0 113.092 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.72 150.25 1.3 Allowed Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.389 2.676 . . . . 20.0 113.44 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -64.92 159.84 44.17 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 123.196 2.597 . . . . 20.0 112.849 -170.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 71.7 mt -62.49 -20.51 64.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.342 0.657 . . . . 20.0 112.501 170.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -78.45 -17.62 56.08 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.562 1.545 . . . . 20.0 113.24 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 158.01 33.02 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.642 1.177 . . . . 20.0 110.807 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -70.92 -9.28 57.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.807 1.643 . . . . 20.0 114.641 -174.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.9 m -60.07 154.93 18.11 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 125.336 1.454 . . . . 20.0 111.61 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -154.38 118.32 4.7 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.126 1.37 . . . . 20.0 110.687 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 6.8 tp10 -158.75 -168.67 2.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.248 1.419 . . . . 20.0 109.887 174.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.498 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.9 pp -59.7 158.35 10.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.962 1.705 . . . . 20.0 113.146 171.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -114.84 -10.28 12.38 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.694 1.598 . . . . 20.0 113.291 174.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.15 -56.26 24.35 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 124.058 0.943 . . . . 20.0 112.295 -176.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -85.6 -27.56 25.4 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.893 0.877 . . . . 20.0 112.362 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.48 -32.77 74.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.1 0.96 . . . . 20.0 112.668 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.87 -1.76 0.71 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.507 2.323 . . . . 20.0 115.921 -168.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.6 m -58.66 -22.7 57.6 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.87 1.268 . . . . 20.0 113.594 172.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.43 -8.44 58.49 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.758 1.163 . . . . 20.0 113.793 171.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 89.02 -73.77 2.1 Favored Glycine 0 C--N 1.343 0.935 0 C-N-CA 125.433 1.492 . . . . 20.0 112.306 172.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -133.43 151.64 51.83 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.182 1.793 . . . . 20.0 109.098 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.0 42.45 98.23 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 118.344 -1.253 . . . . 20.0 113.772 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.19 157.92 40.45 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.896 1.278 . . . . 20.0 112.239 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 12.9 ptpt -166.12 132.9 2.63 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.55 1.54 . . . . 20.0 110.512 171.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 156.76 36.33 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.788 0.435 . . . . 20.0 111.207 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.5 t -164.99 13.62 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.736 0.814 . . . . 20.0 112.698 -170.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.1 t . . . . . 0 CA--C 1.538 0.496 0 C-N-CA 125.037 1.335 . . . . 20.0 111.103 -169.523 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 N--CA 1.463 0.214 0 CA-C-O 119.343 -0.361 . . . . 20.0 110.421 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.7 t -62.92 -42.75 99.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.588 0.755 . . . . 20.0 112.327 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.33 -39.82 72.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.01 0.924 . . . . 20.0 110.796 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 t -63.04 -34.05 76.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.822 1.249 . . . . 20.0 112.899 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -74.39 -19.14 60.53 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.795 1.638 . . . . 20.0 112.706 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.37 14.59 35.04 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.945 1.26 . . . . 20.0 114.538 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -75.4 175.04 8.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.765 1.283 . . . . 20.0 112.231 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.5 1.95 13.97 Favored Glycine 0 C--N 1.343 0.962 0 N-CA-C 117.481 1.752 . . . . 20.0 117.481 -160.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m 34.34 61.92 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.266 2.627 . . . . 20.0 113.69 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.5 157.05 87.13 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.296 0.638 . . . . 20.0 109.939 173.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.04 165.39 32.74 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.985 2.457 . . . . 20.0 111.156 174.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -59.87 -38.95 83.66 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.498 0.719 . . . . 20.0 110.664 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 88.9 p -67.38 -10.05 47.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.009 1.724 . . . . 20.0 115.056 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -122.24 -45.05 2.24 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 124.753 1.221 . . . . 20.0 111.001 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.2 t -65.14 119.44 58.89 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.926 1.29 . . . . 20.0 110.331 175.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.15 155.09 72.19 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.357 2.038 . . . . 20.0 110.201 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -69.37 -19.68 63.83 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.215 1.006 . . . . 20.0 112.641 -167.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -74.97 -39.12 61.46 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.76 2.424 . . . . 20.0 112.675 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.47 -9.66 59.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.508 1.123 . . . . 20.0 113.459 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -69.72 117.53 11.43 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 124.007 0.923 . . . . 20.0 110.528 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 mt -88.06 176.38 7.33 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.519 1.528 . . . . 20.0 111.46 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.3 p -105.45 -6.75 19.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.335 1.454 . . . . 20.0 114.004 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.97 172.54 7.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.712 1.205 . . . . 20.0 111.855 175.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.27 177.39 17.2 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.877 1.227 . . . . 20.0 112.771 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.14 -4.1 31.61 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.767 1.651 . . . . 20.0 114.397 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.3 m -77.4 179.85 6.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.233 1.413 . . . . 20.0 112.468 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.7 m -103.16 -11.95 17.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.4 1.08 . . . . 20.0 112.233 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 p -138.32 -71.98 0.41 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.055 1.742 . . . . 20.0 109.654 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -158.36 153.39 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 126.196 1.798 . . . . 20.0 108.724 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 60.9 m -74.26 155.04 38.68 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.519 0.728 . . . . 20.0 111.033 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.9 t -149.32 114.2 5.39 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.394 0.678 . . . . 20.0 110.526 176.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.27 108.58 4.25 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.496 1.118 . . . . 20.0 110.915 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.63 -27.4 58.41 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.763 0.825 . . . . 20.0 113.088 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -73.95 -11.79 60.45 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.084 1.142 . . . . 20.0 114.084 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt . . . . . 0 CA--C 1.541 0.612 0 C-N-CA 127.075 2.15 . . . . 20.0 111.355 179.79 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp . . . . . 0 CA--C 1.536 0.411 0 N-CA-C 112.823 0.675 . . . . 20.0 112.823 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.61 -43.04 1.15 Allowed Glycine 0 C--N 1.339 0.702 0 C-N-CA 125.262 1.41 . . . . 20.0 111.146 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.37 167.58 43.78 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.497 1.523 . . . . 20.0 112.459 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.18 157.85 44.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.503 1.921 . . . . 20.0 110.819 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -82.06 109.36 16.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.152 0.981 . . . . 20.0 109.394 173.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -127.1 155.01 76.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.236 2.214 . . . . 20.0 109.971 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.45 164.78 27.25 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.981 3.121 . . . . 20.0 113.428 -168.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 48.6 mt -59.97 -28.85 68.01 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.518 0.727 . . . . 20.0 111.588 168.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.21 -18.51 65.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.696 1.598 . . . . 20.0 112.725 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -65.98 -30.47 71.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.621 1.168 . . . . 20.0 112.316 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.88 1.11 0.78 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.646 2.378 . . . . 20.0 115.612 173.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.6 p -65.59 167.76 8.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.805 1.242 . . . . 20.0 111.68 172.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -63.68 134.15 54.87 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.253 1.021 . . . . 20.0 110.018 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.96 172.55 12.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.611 1.165 . . . . 20.0 112.116 175.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 162.54 29.47 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.978 2.111 . . . . 20.0 110.979 172.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -88.02 -2.28 58.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.633 1.573 . . . . 20.0 113.336 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.29 -70.2 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.483 1.513 . . . . 20.0 110.742 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -83.98 -27.19 28.63 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.499 0.926 . . . . 20.0 113.499 -176.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.3 p -66.19 -21.94 66.33 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.14 -11.0 35.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.993 1.317 . . . . 20.0 112.685 173.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.6 t -107.34 -30.57 8.62 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.887 1.675 . . . . 20.0 112.198 171.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 75.0 m -61.61 -27.23 68.51 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.368 0.986 . . . . 20.0 112.516 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.5 166.77 42.81 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.249 1.404 . . . . 20.0 112.712 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -62.94 133.84 55.27 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.789 1.236 . . . . 20.0 111.067 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.27 -2.41 65.5 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.162 1.363 . . . . 20.0 113.353 -172.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -149.96 137.8 20.15 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.921 1.361 . . . . 20.0 111.814 -170.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.58 172.37 12.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.642 1.977 . . . . 20.0 112.146 -174.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.89 137.58 51.76 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 122.009 -0.432 . . . . 20.0 109.976 167.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.6 t -138.27 168.33 19.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.783 1.633 . . . . 20.0 108.576 163.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p . . . . . 0 N--CA 1.466 0.33 0 C-N-CA 123.169 0.587 . . . . 20.0 109.966 170.392 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 111.366 0.136 . . . . 20.0 111.366 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.4 t -70.65 -37.42 73.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.542 1.137 . . . . 20.0 112.239 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.31 -37.63 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.305 . . . . 20.0 110.709 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.2 t -58.28 -37.55 75.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.875 1.27 . . . . 20.0 112.075 178.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -77.77 -46.28 22.13 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.518 1.127 . . . . 20.0 111.575 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.59 63.63 2.56 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.419 1.009 . . . . 20.0 112.378 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -95.28 -102.26 0.16 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.57 1.548 . . . . 20.0 108.741 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.58 165.58 35.08 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.153 1.359 . . . . 20.0 111.416 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.9 m -125.45 55.96 1.39 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.276 1.43 . . . . 20.0 110.132 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.42 154.74 90.13 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.074 0.95 . . . . 20.0 109.803 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -69.79 160.08 51.02 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.026 2.484 . . . . 20.0 110.408 170.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.9 -37.31 84.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.768 0.827 . . . . 20.0 112.074 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.0 m -68.72 -21.69 64.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.781 1.03 . . . . 20.0 113.781 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -92.06 -51.13 5.34 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.503 1.121 . . . . 20.0 110.571 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.3 t -62.93 118.51 43.05 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 125.517 1.527 . . . . 20.0 110.941 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.01 155.57 69.13 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.382 2.055 . . . . 20.0 110.206 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -74.08 -16.26 61.04 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.627 1.171 . . . . 20.0 112.72 -165.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.55 -39.82 64.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.649 2.38 . . . . 20.0 112.239 170.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.16 -11.18 59.77 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.612 1.165 . . . . 20.0 113.455 -176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -67.54 112.68 4.83 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.806 0.842 . . . . 20.0 110.694 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.6 mt -78.12 175.99 9.62 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.368 1.867 . . . . 20.0 111.153 174.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.7 p -110.81 -0.25 17.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.719 1.608 . . . . 20.0 112.804 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -72.07 171.57 11.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.73 1.212 . . . . 20.0 111.906 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -129.69 141.84 13.02 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.032 1.301 . . . . 20.0 111.275 174.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 150.09 -14.69 1.0 Allowed Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.763 1.173 . . . . 20.0 114.101 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -77.72 -179.55 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.899 1.35 . . . . 20.0 112.371 172.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.1 t -107.02 -9.53 16.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.496 1.518 . . . . 20.0 111.766 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 p -137.54 -69.61 0.45 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 125.425 1.49 . . . . 20.0 110.158 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.2 p -159.26 144.32 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 20.0 109.86 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 92.4 m -72.99 120.33 18.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.537 1.535 . . . . 20.0 110.173 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.0 t -126.33 108.34 11.15 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.544 1.138 . . . . 20.0 110.607 -171.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -65.04 106.09 1.19 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.54 1.936 . . . . 20.0 111.29 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.2 mt -80.67 -18.2 48.77 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.934 0.894 . . . . 20.0 112.913 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -77.51 -10.57 59.56 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.761 1.225 . . . . 20.0 113.398 -175.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt . . . . . 0 CA--C 1.536 0.427 0 C-N-CA 126.05 1.74 . . . . 20.0 112.998 172.67 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt . . . . . 0 CA--C 1.537 0.45 0 N-CA-C 112.5 0.556 . . . . 20.0 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.6 -24.54 16.8 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.617 1.58 . . . . 20.0 114.094 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.53 -162.66 37.12 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.708 1.147 . . . . 20.0 114.275 173.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -120.99 141.35 50.81 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.121 1.768 . . . . 20.0 109.208 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.9 t -89.05 17.08 6.14 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.928 1.291 . . . . 20.0 113.153 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -43.9 153.02 0.43 Allowed Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 128.92 2.888 . . . . 20.0 114.378 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.85 161.87 44.28 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.618 2.878 . . . . 20.0 112.474 -177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.8 mt -63.62 -18.96 64.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.846 1.258 . . . . 20.0 112.272 172.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -69.45 -25.65 64.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.356 1.463 . . . . 20.0 112.577 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -69.95 160.59 31.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.183 0.993 . . . . 20.0 111.238 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -74.33 97.77 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.381 1.072 . . . . 20.0 110.896 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 98.7 m -153.77 154.84 34.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.782 2.433 . . . . 20.0 109.07 174.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -154.99 92.21 1.43 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.076 1.35 . . . . 20.0 110.394 175.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.483 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.5 tp10 -153.94 -174.7 5.06 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.191 0.996 . . . . 20.0 110.897 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.483 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.5 pp -57.07 158.46 5.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.965 1.706 . . . . 20.0 113.826 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -118.56 -9.11 10.34 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.751 2.021 . . . . 20.0 112.654 175.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -20.0 65.0 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.053 1.341 . . . . 20.0 114.069 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -124.67 -17.92 5.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.344 1.458 . . . . 20.0 111.843 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.5 t -79.29 -20.94 46.76 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.978 1.311 . . . . 20.0 113.498 177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -0.46 5.72 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.239 1.415 . . . . 20.0 114.449 -174.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.6 t -56.64 -45.01 81.85 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.75 1.22 . . . . 20.0 111.602 166.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -69.99 -6.41 33.12 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.485 1.114 . . . . 20.0 113.461 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.21 -166.62 14.57 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.714 1.626 . . . . 20.0 112.389 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.03 46.42 0.39 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.416 1.886 . . . . 20.0 110.537 168.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -150.33 3.99 0.57 Allowed Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.46 1.981 . . . . 20.0 113.329 -173.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -142.61 152.98 43.07 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.675 1.738 . . . . 20.0 110.817 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -132.49 147.98 52.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.582 2.353 . . . . 20.0 108.114 165.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.2 t -60.8 142.74 55.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.848 0.356 . . . . 20.0 111.074 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.9 t -158.17 4.66 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.038 0.755 . . . . 20.0 113.038 -171.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.347 1.459 . . . . 20.0 111.69 -179.047 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 119.341 -0.362 . . . . 20.0 110.698 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 p -68.46 -28.25 66.88 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 114.557 1.317 . . . . 20.0 114.557 -167.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.0 t -57.27 -49.34 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.544 1.138 . . . . 20.0 109.617 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.4 t -71.65 -27.26 62.95 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.733 1.213 . . . . 20.0 112.786 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -67.52 -24.97 65.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.208 1.003 . . . . 20.0 112.419 175.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.23 -1.11 14.52 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.181 1.372 . . . . 20.0 114.176 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -77.95 172.14 13.93 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.753 1.277 . . . . 20.0 112.222 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.9 -7.04 29.73 Favored Glycine 0 C--N 1.341 0.839 0 N-CA-C 118.019 1.968 . . . . 20.0 118.019 -153.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.0 m 37.54 53.93 1.41 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.801 2.44 . . . . 20.0 113.76 -171.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.55 154.25 80.27 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 123.166 0.587 . . . . 20.0 109.646 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.7 161.97 41.41 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.86 2.373 . . . . 20.0 111.256 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -65.64 -18.33 65.24 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.403 0.681 . . . . 20.0 111.604 175.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.7 m -68.29 -43.57 77.42 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.681 1.192 . . . . 20.0 112.231 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -89.4 -48.34 7.4 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.821 0.848 . . . . 20.0 112.285 -174.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.19 118.92 51.28 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.004 1.321 . . . . 20.0 110.683 -176.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -71.06 157.99 56.32 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.916 2.41 . . . . 20.0 110.042 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -73.26 -16.58 61.39 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.0 0.92 . . . . 20.0 112.954 -164.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -72.44 -40.47 67.05 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.174 2.59 . . . . 20.0 112.221 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 -6.78 59.51 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.615 1.566 . . . . 20.0 113.616 -176.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -71.53 101.99 2.6 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 123.868 0.867 . . . . 20.0 111.036 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.73 170.86 7.19 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.085 1.754 . . . . 20.0 111.178 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.6 t -110.47 -3.21 16.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.486 1.514 . . . . 20.0 112.984 -174.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -63.74 175.38 1.13 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.243 1.817 . . . . 20.0 111.85 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.79 178.53 16.35 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.235 1.398 . . . . 20.0 112.754 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.06 -3.85 33.63 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.97 1.271 . . . . 20.0 115.085 171.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.7 m -77.48 176.38 8.94 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.196 1.498 . . . . 20.0 113.143 177.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -85.7 -17.67 35.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.728 -1.124 . . . . 20.0 110.84 166.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -143.08 -70.83 0.32 Allowed 'General case' 0 C--N 1.344 0.357 0 C-N-CA 125.428 1.491 . . . . 20.0 111.783 -168.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -164.88 137.38 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.506 1.522 . . . . 20.0 109.412 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -70.48 128.09 34.95 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.439 1.096 . . . . 20.0 109.491 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.8 t -130.89 114.71 15.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.574 1.149 . . . . 20.0 110.609 -172.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -67.11 121.4 15.53 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.327 0.584 . . . . 20.0 112.138 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.47 -26.22 14.91 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.694 1.198 . . . . 20.0 112.164 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.2 m -68.55 -10.94 58.93 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.397 1.479 . . . . 20.0 114.187 -173.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.3 ptmm? . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 126.419 1.887 . . . . 20.0 113.17 -175.651 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 113.401 0.889 . . . . 20.0 113.401 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 105.67 54.37 0.73 Allowed Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.559 1.076 . . . . 20.0 112.016 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.62 177.5 18.99 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 124.974 1.273 . . . . 20.0 113.357 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.32 157.53 45.42 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.563 1.545 . . . . 20.0 112.581 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -101.28 44.96 0.99 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.13 2.172 . . . . 20.0 111.185 -168.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -63.72 163.88 19.2 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.624 1.97 . . . . 20.0 113.49 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.31 163.46 34.36 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.824 3.016 . . . . 20.0 112.83 -177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.5 mt -68.04 -20.46 64.98 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.656 1.182 . . . . 20.0 112.003 171.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.99 -39.99 96.41 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.928 1.691 . . . . 20.0 111.031 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -74.37 132.45 42.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.305 1.042 . . . . 20.0 109.058 173.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.73 122.83 22.99 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.145 0.578 . . . . 20.0 110.062 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -168.7 166.44 11.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.401 1.48 . . . . 20.0 111.233 176.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -77.58 166.16 23.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.939 1.296 . . . . 20.0 110.665 174.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -132.6 140.65 48.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.449 1.499 . . . . 20.0 110.393 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.1 118.59 16.88 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.785 2.034 . . . . 20.0 110.885 -171.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -63.32 -17.45 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.986 1.314 . . . . 20.0 114.527 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.76 -20.38 61.19 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.95 1.3 . . . . 20.0 113.834 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -139.32 -37.0 0.51 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.97 . . . . 20.0 112.286 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.9 t -69.55 -21.55 63.62 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.749 1.219 . . . . 20.0 112.724 178.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.09 -8.78 18.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.888 0.875 . . . . 20.0 112.822 172.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.7 t -100.49 -26.76 13.74 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.288 1.435 . . . . 20.0 112.436 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 94.3 m -66.38 -44.64 82.57 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.178 0.899 . . . . 20.0 110.632 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 68.75 -179.27 22.87 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.603 1.097 . . . . 20.0 113.487 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -50.12 135.17 21.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.735 1.614 . . . . 20.0 112.398 -176.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.19 -28.58 15.08 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.194 1.854 . . . . 20.0 113.242 -175.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -142.51 -178.79 5.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.5 1.52 . . . . 20.0 111.734 -176.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -165.72 152.59 10.0 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.962 1.305 . . . . 20.0 111.361 -175.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.93 148.16 36.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.252 0.621 . . . . 20.0 110.128 166.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 20.2 t -149.21 140.82 23.44 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.918 1.687 . . . . 20.0 108.292 170.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 t . . . . . 0 CA--C 1.539 0.539 0 C-N-CA 124.927 1.291 . . . . 20.0 109.257 -169.46 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 . . . . . 0 N--CA 1.465 0.29 0 CA-C-O 118.99 -0.529 . . . . 20.0 111.876 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -58.66 -38.51 78.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.269 0.627 . . . . 20.0 110.785 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.14 -43.26 95.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.489 1.516 . . . . 20.0 110.986 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.3 m -63.26 -36.25 83.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.408 1.083 . . . . 20.0 112.41 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.1 -12.06 60.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.875 1.27 . . . . 20.0 112.751 176.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.59 1.19 53.07 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.61 1.576 . . . . 20.0 115.008 173.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -79.54 179.92 7.2 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.61 1.564 . . . . 20.0 111.995 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.1 174.91 15.44 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.603 1.573 . . . . 20.0 113.064 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.3 m -118.24 41.87 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.134 1.374 . . . . 20.0 112.054 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 143.9 97.49 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 122.976 0.51 . . . . 20.0 109.885 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.58 166.62 29.33 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.439 2.759 . . . . 20.0 112.797 -173.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -64.38 -25.74 68.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.564 1.545 . . . . 20.0 112.362 178.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.2 m -77.72 -12.85 60.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.435 1.494 . . . . 20.0 113.815 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.87 -66.97 1.03 Allowed 'General case' 0 C--N 1.344 0.351 0 C-N-CA 124.577 1.151 . . . . 20.0 110.513 -170.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.4 158.54 28.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.462 0.705 . . . . 20.0 112.075 176.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -83.13 170.13 12.38 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.847 3.031 . . . . 20.0 111.892 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -83.77 -5.65 59.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.335 1.454 . . . . 20.0 113.337 -173.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -90.75 -32.43 16.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.82 2.048 . . . . 20.0 112.196 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.02 2.63 12.24 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.909 1.684 . . . . 20.0 113.672 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -85.7 102.73 13.87 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.221 1.008 . . . . 20.0 112.704 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.1 mt -74.77 176.42 7.05 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.346 1.858 . . . . 20.0 111.721 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.9 t -137.2 19.15 2.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.169 1.388 . . . . 20.0 113.226 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.06 -100.71 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.563 1.945 . . . . 20.0 111.176 171.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.16 177.8 28.8 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 128.178 2.799 . . . . 20.0 111.407 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.33 38.0 3.64 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 119.092 -0.838 . . . . 20.0 113.931 176.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 68.9 m -132.8 179.39 6.19 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.556 1.543 . . . . 20.0 111.171 176.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.1 m -108.65 -6.28 16.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.397 1.079 . . . . 20.0 112.284 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.1 p -136.77 -67.79 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.644 1.578 . . . . 20.0 109.852 174.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -165.81 163.2 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 127.75 2.42 . . . . 20.0 107.946 -173.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.8 m -97.49 157.73 15.85 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.556 0.743 . . . . 20.0 111.727 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.3 t -146.34 118.22 8.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.418 1.487 . . . . 20.0 109.94 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.96 96.89 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.424 1.09 . . . . 20.0 113.215 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.7 mt -69.26 -9.01 51.18 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.844 1.258 . . . . 20.0 113.585 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.1 t -101.1 -7.58 23.06 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.966 1.306 . . . . 20.0 112.795 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm . . . . . 0 CA--C 1.535 0.386 0 C-N-CA 125.882 1.673 . . . . 20.0 112.898 -177.89 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? . . . . . 0 CA--C 1.536 0.423 0 N-CA-C 112.753 0.649 . . . . 20.0 112.753 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.66 -14.48 2.92 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.395 1.474 . . . . 20.0 114.407 174.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.67 172.11 48.62 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.353 1.454 . . . . 20.0 112.745 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -136.8 171.34 14.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.591 1.556 . . . . 20.0 111.438 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 57.3 m -74.68 25.09 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.138 2.175 . . . . 20.0 114.565 -172.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -55.46 154.02 13.08 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 125.088 1.355 . . . . 20.0 111.116 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.44 163.11 38.52 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.553 2.835 . . . . 20.0 111.782 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.76 -13.89 62.51 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.08 1.352 . . . . 20.0 112.512 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -68.87 -31.78 70.97 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.209 1.404 . . . . 20.0 111.825 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -72.39 135.05 45.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.596 0.758 . . . . 20.0 109.82 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -80.84 104.28 11.25 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.362 1.465 . . . . 20.0 110.952 -176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.47 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 1.3 m -162.04 165.55 27.13 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.466 1.906 . . . . 20.0 110.274 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -68.48 162.11 26.29 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.37 1.068 . . . . 20.0 111.671 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -133.96 125.11 27.51 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.406 1.482 . . . . 20.0 110.855 -173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.9 pp -129.26 170.96 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.319 2.247 . . . . 20.0 110.817 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.67 -5.4 13.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.762 1.225 . . . . 20.0 112.018 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.6 -34.72 62.89 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.56 1.544 . . . . 20.0 113.131 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -138.34 -36.71 0.58 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.422 1.489 . . . . 20.0 111.855 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.6 p -90.12 48.47 1.57 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.079 1.752 . . . . 20.0 110.441 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -130.06 -7.68 4.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.635 1.974 . . . . 20.0 111.98 177.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.7 m -133.8 84.44 2.12 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.769 1.228 . . . . 20.0 111.354 -176.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.5 t -141.12 -55.72 0.49 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 155.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 160.6 -80.78 0.15 Allowed Glycine 0 C--N 1.341 0.861 0 CA-C-N 118.7 0.682 . . . . 20.0 112.175 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -80.24 65.3 5.35 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 126.443 1.897 . . . . 20.0 110.922 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 45.93 78.85 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 128.464 2.935 . . . . 20.0 112.443 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -63.68 133.84 54.32 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.448 -0.876 . . . . 20.0 109.204 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -142.39 130.64 22.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.115 0.966 . . . . 20.0 111.203 171.387 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.2 t -53.25 120.0 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.46 1.904 . . . . 20.0 111.722 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.9 t -158.97 85.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.743 0.817 . . . . 20.0 110.446 -172.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.48 1.059 0 C-N-CA 124.406 1.082 . . . . 20.0 113.082 -174.848 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 112.098 0.407 . . . . 20.0 112.098 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 t -61.31 -47.05 87.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.349 1.46 . . . . 20.0 111.871 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 88.8 t -77.58 -31.34 17.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.455 1.502 . . . . 20.0 111.411 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.2 m -63.7 -41.92 98.04 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.508 1.123 . . . . 20.0 111.738 173.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.55 -16.61 61.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.05 0.94 . . . . 20.0 112.879 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.64 52.67 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.786 1.184 . . . . 20.0 114.306 172.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -83.73 178.52 7.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.365 1.466 . . . . 20.0 112.321 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.52 175.26 15.67 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.493 1.521 . . . . 20.0 112.449 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.6 m -123.27 52.56 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.297 1.439 . . . . 20.0 111.144 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.65 153.04 88.47 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.008 0.923 . . . . 20.0 109.55 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.85 164.09 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.005 2.47 . . . . 20.0 111.63 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -62.42 -27.8 69.35 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.414 1.486 . . . . 20.0 111.229 172.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.6 m -64.66 -34.06 77.41 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 125.184 1.394 . . . . 20.0 112.473 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.37 -70.08 0.64 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.243 1.017 . . . . 20.0 110.518 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 m -69.94 144.22 92.8 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 124.168 0.987 . . . . 20.0 111.492 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.04 170.64 17.59 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.045 3.164 . . . . 20.0 111.781 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -70.44 -23.49 62.73 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.584 1.154 . . . . 20.0 113.218 -170.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -81.77 -36.88 28.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.265 2.226 . . . . 20.0 112.459 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.86 -8.07 52.14 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.928 1.291 . . . . 20.0 113.486 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -72.15 101.69 2.85 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.115 1.366 . . . . 20.0 110.813 -178.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.93 169.96 10.65 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.123 1.769 . . . . 20.0 111.742 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.6 p -98.17 -11.67 22.54 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.339 1.456 . . . . 20.0 113.743 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -69.42 163.62 24.84 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.437 1.095 . . . . 20.0 112.032 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.55 174.49 15.49 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.207 1.384 . . . . 20.0 111.849 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.29 -3.97 20.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.045 1.307 . . . . 20.0 113.787 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.32 179.41 5.89 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.263 1.425 . . . . 20.0 112.363 175.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -97.46 -13.67 21.61 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.64 1.176 . . . . 20.0 112.042 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -142.94 -71.07 0.32 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.761 1.624 . . . . 20.0 110.33 -173.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -159.1 145.29 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.461 1.104 . . . . 20.0 109.927 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.0 m -77.35 131.83 38.28 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.503 1.121 . . . . 20.0 109.702 169.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.6 t -124.32 118.8 27.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.623 1.169 . . . . 20.0 109.592 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.83 86.18 0.5 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.713 1.205 . . . . 20.0 112.536 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 mt -63.72 -30.97 72.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.517 1.127 . . . . 20.0 112.68 -178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.1 t -64.11 -34.77 78.81 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 123.919 0.888 . . . . 20.0 111.55 177.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 69.1 mttt . . . . . 0 N--CA 1.467 0.381 0 C-N-CA 124.304 1.042 . . . . 20.0 112.759 -174.521 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt . . . . . 0 N--CA 1.454 -0.235 0 N-CA-C 107.921 -1.14 . . . . 20.0 107.921 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.0 29.05 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.406 1.003 . . . . 20.0 113.012 -166.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.7 -125.14 3.05 Favored Glycine 0 C--N 1.343 0.942 0 C-N-CA 125.038 1.304 . . . . 20.0 111.513 -174.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.82 167.02 23.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.478 1.111 . . . . 20.0 112.653 -171.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 32.7 t -112.1 82.09 1.57 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.317 1.447 . . . . 20.0 109.937 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.6 164.64 36.63 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 126.04 1.736 . . . . 20.0 111.104 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.94 167.98 20.07 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.587 2.858 . . . . 20.0 112.921 -175.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.3 mt -64.63 -19.82 65.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.315 1.046 . . . . 20.0 112.65 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.29 -27.02 69.05 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.855 1.662 . . . . 20.0 111.926 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -70.46 127.84 34.11 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 125.021 1.328 . . . . 20.0 109.731 -177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -75.29 101.13 4.59 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.415 0.686 . . . . 20.0 110.247 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 p -160.97 -179.98 7.98 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.698 1.599 . . . . 20.0 111.194 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -59.38 165.54 2.72 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.715 2.006 . . . . 20.0 111.648 -177.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -139.44 128.55 23.81 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 125.855 1.662 . . . . 20.0 109.63 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.6 mt -150.79 115.29 5.16 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.422 1.889 . . . . 20.0 109.769 176.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -64.9 -18.93 65.63 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.529 0.936 . . . . 20.0 113.529 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.02 -17.21 60.55 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.964 1.305 . . . . 20.0 114.032 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -129.54 -49.99 1.16 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.707 1.203 . . . . 20.0 112.593 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.5 p -63.73 -18.59 64.19 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.025 1.12 . . . . 20.0 114.025 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.62 -13.5 42.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.467 1.507 . . . . 20.0 113.54 173.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 t -63.28 -46.03 88.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.522 1.129 . . . . 20.0 111.451 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -12.2 57.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.415 0.686 . . . . 20.0 112.539 169.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.61 -162.33 34.43 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.766 1.174 . . . . 20.0 112.664 178.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -74.83 46.46 0.29 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.511 1.924 . . . . 20.0 113.445 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.6 7.94 1.55 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 126.48 1.991 . . . . 20.0 112.528 173.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -144.86 161.74 38.56 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.848 1.259 . . . . 20.0 110.642 176.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.05 149.1 34.49 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.391 2.676 . . . . 20.0 108.444 173.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.6 t -52.64 109.0 0.35 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.854 0.862 . . . . 20.0 111.268 -173.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.36 18.29 13.68 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.154 0.982 . . . . 20.0 113.228 -167.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 C--N 1.343 0.3 0 C-N-CA 125.356 1.463 . . . . 20.0 107.995 -170.24 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 . . . . . 0 CA--C 1.537 0.449 0 N-CA-C 111.657 0.243 . . . . 20.0 111.657 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -58.4 -54.78 43.11 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.324 1.45 . . . . 20.0 111.279 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 50.9 t -67.52 -34.4 68.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.119 1.368 . . . . 20.0 111.066 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.9 t -62.42 -41.48 98.72 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.101 1.361 . . . . 20.0 111.589 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -76.04 -14.02 60.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.609 1.164 . . . . 20.0 113.03 175.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.51 -2.03 53.41 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.781 1.658 . . . . 20.0 113.867 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -76.66 176.98 7.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.383 1.473 . . . . 20.0 111.714 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.79 176.45 18.16 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.886 1.232 . . . . 20.0 111.986 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -124.82 76.39 1.51 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.775 1.23 . . . . 20.0 108.702 172.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -77.53 156.1 81.0 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.339 1.056 . . . . 20.0 109.534 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.94 160.13 51.09 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.5 2.134 . . . . 20.0 111.34 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -64.75 -20.85 66.59 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.986 0.914 . . . . 20.0 112.715 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.0 t -68.11 -55.72 11.45 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.017 0.927 . . . . 20.0 110.896 172.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.03 -54.97 9.3 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.45 1.1 . . . . 20.0 111.775 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 t -62.35 115.86 19.02 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.363 1.065 . . . . 20.0 110.889 -177.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -69.04 156.45 65.18 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.785 2.323 . . . . 20.0 110.592 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -72.84 -17.0 61.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.819 0.848 . . . . 20.0 112.977 -166.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 4.7 pt-20 -72.61 -40.91 66.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.288 2.635 . . . . 20.0 111.97 173.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.37 -10.68 59.75 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.036 1.334 . . . . 20.0 112.937 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -66.46 119.5 11.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.202 1.001 . . . . 20.0 110.78 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -90.54 172.82 8.43 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.025 1.33 . . . . 20.0 110.715 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 t -87.54 -14.79 39.28 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.809 1.244 . . . . 20.0 112.204 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -63.64 165.34 8.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.408 1.483 . . . . 20.0 112.538 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.83 -168.77 11.9 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.177 1.37 . . . . 20.0 113.343 -171.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.2 -11.11 73.12 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.224 1.869 . . . . 20.0 113.421 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 77.2 m -67.17 172.23 4.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.62 1.168 . . . . 20.0 111.748 174.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.2 p -106.33 -5.77 18.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.097 1.759 . . . . 20.0 113.533 173.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -139.36 -72.64 0.39 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.266 1.827 . . . . 20.0 109.993 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -164.11 155.32 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.982 1.713 . . . . 20.0 109.002 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -76.02 160.02 30.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.883 0.873 . . . . 20.0 110.403 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.95 117.97 5.9 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.952 0.501 . . . . 20.0 110.825 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -71.74 93.74 1.31 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.805 1.242 . . . . 20.0 110.377 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.95 -22.28 64.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.452 1.101 . . . . 20.0 112.888 -177.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.0 t -74.14 -15.52 61.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.746 1.218 . . . . 20.0 113.023 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? . . . . . 0 CA--C 1.534 0.338 0 C-N-CA 125.767 1.627 . . . . 20.0 113.243 175.994 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt . . . . . 0 N--CA 1.466 0.355 0 N-CA-C 111.819 0.303 . . . . 20.0 111.819 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 151.23 -25.25 0.99 Allowed Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.456 1.503 . . . . 20.0 112.881 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 98.86 156.57 29.24 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.637 1.589 . . . . 20.0 111.192 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -137.42 136.02 37.45 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 125.159 1.383 . . . . 20.0 109.34 -179.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.8 m -82.56 94.89 7.6 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.405 0.682 . . . . 20.0 109.518 174.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.63 154.7 60.12 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 125.809 1.643 . . . . 20.0 110.858 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -68.39 156.48 65.49 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.676 2.917 . . . . 20.0 112.362 -170.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.91 -19.84 65.8 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.595 0.758 . . . . 20.0 112.665 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -69.04 -27.02 65.27 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.929 1.692 . . . . 20.0 112.577 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -76.38 134.32 39.68 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.335 0.654 . . . . 20.0 109.993 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.15 99.22 0.87 Allowed 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.631 1.172 . . . . 20.0 110.157 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.33 173.43 8.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.866 1.266 . . . . 20.0 111.472 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -68.25 166.95 15.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.534 1.133 . . . . 20.0 111.439 177.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -142.95 140.19 31.0 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.188 1.795 . . . . 20.0 109.447 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.48 87.75 1.74 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.354 1.461 . . . . 20.0 111.337 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -68.18 -9.57 47.79 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.749 1.018 . . . . 20.0 113.749 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.43 -7.62 40.97 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.547 1.539 . . . . 20.0 113.534 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.25 -56.78 0.65 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.922 1.289 . . . . 20.0 111.047 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 t -66.27 -20.55 66.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.221 1.408 . . . . 20.0 113.184 -176.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.63 -6.65 1.21 Allowed 'General case' 0 C--N 1.344 0.365 0 C-N-CA 126.966 2.106 . . . . 20.0 114.963 -178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.1 t -54.58 -28.84 48.97 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.391 0.996 . . . . 20.0 113.362 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 68' ' ' GLN . 1.3 m -71.4 -75.69 0.12 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.22 1.008 . . . . 20.0 109.142 165.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 145.13 -62.64 0.47 Allowed Glycine 0 C--N 1.347 1.144 0 C-N-CA 123.918 0.771 . . . . 20.0 112.463 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 144.12 50.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.982 1.313 . . . . 20.0 110.291 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 55.59 46.92 80.19 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.037 1.303 . . . . 20.0 113.069 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.426 ' HB2' ' HB2' ' A' ' 64' ' ' CYS . 5.1 pm0 -127.5 -0.11 6.23 Favored 'General case' 0 C--N 1.347 0.471 0 N-CA-C 118.837 2.902 . . . . 20.0 118.837 -165.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -41.15 127.3 2.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.113 2.165 . . . . 20.0 113.981 -168.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 44.4 t -60.49 111.93 1.78 Allowed 'General case' 0 C--N 1.345 0.388 0 C-N-CA 123.904 0.881 . . . . 20.0 109.751 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.6 t -130.17 83.43 2.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.957 1.303 . . . . 20.0 108.332 -174.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.9 t . . . . . 0 CA--C 1.529 0.166 0 C-N-CA 126.016 1.727 . . . . 20.0 108.276 -177.029 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 112.964 0.727 . . . . 20.0 112.964 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.7 t -63.4 -35.99 82.23 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.473 1.109 . . . . 20.0 111.895 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.4 t -76.74 -41.95 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.376 1.47 . . . . 20.0 110.634 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.6 m -62.17 -38.65 89.87 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.88 1.272 . . . . 20.0 112.743 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -71.67 -15.94 62.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.736 1.214 . . . . 20.0 113.085 175.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.67 -1.07 56.77 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 125.211 1.386 . . . . 20.0 114.535 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -74.59 176.71 6.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.465 1.132 . . . . 20.0 111.333 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 178.65 19.18 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.049 1.309 . . . . 20.0 112.57 -176.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -131.63 68.31 1.5 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.383 1.473 . . . . 20.0 109.67 176.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.54 155.75 87.88 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 109.238 -0.653 . . . . 20.0 109.238 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.79 166.7 28.7 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.7 2.267 . . . . 20.0 111.018 174.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -63.64 -22.49 66.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.602 0.761 . . . . 20.0 111.753 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -74.04 -16.39 61.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.434 1.494 . . . . 20.0 113.899 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -126.1 -37.92 2.21 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.894 1.278 . . . . 20.0 112.597 -174.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -71.22 125.89 91.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 123.861 0.864 . . . . 20.0 110.039 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -69.12 153.53 71.74 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.688 2.258 . . . . 20.0 109.752 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -73.44 -14.4 61.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.361 1.065 . . . . 20.0 112.955 -167.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.434 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.7 pt-20 -76.56 -42.08 44.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.693 2.397 . . . . 20.0 112.226 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.9 -11.5 59.82 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.808 1.243 . . . . 20.0 113.577 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -67.34 108.07 2.63 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.301 1.04 . . . . 20.0 111.127 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.6 mt -76.07 172.39 12.86 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.883 1.273 . . . . 20.0 112.334 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 55.9 m -90.51 -11.22 40.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.192 1.397 . . . . 20.0 112.953 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -71.71 175.06 6.0 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.799 1.24 . . . . 20.0 112.96 -176.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.21 177.52 18.17 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.524 1.535 . . . . 20.0 112.681 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.34 -11.06 26.36 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.972 1.749 . . . . 20.0 113.373 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.2 m -74.67 178.36 5.47 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.395 1.478 . . . . 20.0 112.263 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 m -115.55 -5.17 12.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.164 1.386 . . . . 20.0 112.322 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -138.75 -74.63 0.38 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.683 1.993 . . . . 20.0 109.204 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -161.1 158.83 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 126.636 1.974 . . . . 20.0 108.271 179.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 31.8 m -75.18 163.07 27.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.808 0.843 . . . . 20.0 111.358 171.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.87 118.66 5.77 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.194 0.997 . . . . 20.0 110.084 170.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -69.3 100.45 1.34 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.811 1.245 . . . . 20.0 109.547 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 mt -67.95 -24.95 65.23 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.318 1.047 . . . . 20.0 112.267 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.8 t -74.93 -5.7 45.21 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.153 1.381 . . . . 20.0 112.499 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.2 mttt . . . . . 0 N--CA 1.467 0.425 0 C-N-CA 125.934 1.694 . . . . 20.0 111.981 174.479 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt . . . . . 0 CA--C 1.532 0.27 0 N-CA-C 108.72 -0.844 . . . . 20.0 108.72 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.56 -49.03 0.02 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.838 1.209 . . . . 20.0 111.705 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.39 101.11 0.69 Allowed Glycine 0 C--N 1.342 0.89 0 C-N-CA 124.454 1.026 . . . . 20.0 111.271 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.18 150.31 47.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.872 0.869 . . . . 20.0 111.472 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.4 t -110.87 28.66 8.49 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.821 1.648 . . . . 20.0 111.711 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -45.14 149.8 0.86 Allowed Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 127.809 2.444 . . . . 20.0 113.821 159.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.88 159.45 41.73 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.12 3.213 . . . . 20.0 112.84 -171.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.33 -18.78 64.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.332 1.053 . . . . 20.0 113.759 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.09 -29.8 67.97 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.994 1.318 . . . . 20.0 112.624 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -73.06 138.91 46.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.571 0.748 . . . . 20.0 110.664 -175.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -71.73 104.27 3.34 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.204 1.401 . . . . 20.0 111.329 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -163.5 177.99 8.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.034 1.734 . . . . 20.0 110.077 173.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -69.0 162.49 26.71 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.653 1.181 . . . . 20.0 110.814 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -148.32 134.76 19.62 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.785 1.234 . . . . 20.0 109.978 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.8 mt -146.18 110.91 5.19 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 126.594 1.958 . . . . 20.0 108.729 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.95 -21.67 66.24 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.114 0.783 . . . . 20.0 113.114 -176.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.05 -35.74 74.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.429 1.092 . . . . 20.0 112.185 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -108.24 -31.19 7.99 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.881 1.273 . . . . 20.0 111.89 -170.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.8 p -84.1 -4.8 59.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.283 1.433 . . . . 20.0 113.828 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.3 -9.1 37.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.454 1.102 . . . . 20.0 113.012 174.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.7 t -60.86 -56.34 22.28 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.529 1.532 . . . . 20.0 112.258 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -79.31 -12.45 59.93 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.805 0.73 . . . . 20.0 112.184 172.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.19 -164.81 44.43 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.741 1.162 . . . . 20.0 112.588 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -54.76 107.56 0.3 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.096 1.758 . . . . 20.0 111.635 177.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 134.18 -17.7 4.29 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.288 1.423 . . . . 20.0 112.824 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -110.59 147.99 33.09 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-N 118.967 1.383 . . . . 20.0 111.017 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -132.17 153.81 50.18 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.141 1.777 . . . . 20.0 109.706 175.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.2 t -66.89 96.77 0.44 Allowed 'General case' 0 C--N 1.346 0.443 0 C-N-CA 124.581 1.152 . . . . 20.0 110.92 -176.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 10.8 t -143.39 111.49 6.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.073 1.349 . . . . 20.0 109.811 -176.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 CA--C 1.534 0.347 0 C-N-CA 124.049 0.94 . . . . 20.0 110.302 177.439 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 . . . . . 0 CA--C 1.536 0.411 0 N-CA-C 110.476 -0.194 . . . . 20.0 110.476 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 m -68.64 -27.57 66.12 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.98 1.712 . . . . 20.0 112.774 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.2 -53.3 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.175 1.39 . . . . 20.0 109.981 169.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 t -61.77 -33.53 74.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.237 1.015 . . . . 20.0 112.274 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -72.91 -56.77 4.7 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.566 1.146 . . . . 20.0 110.561 173.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.22 53.07 0.4 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.497 1.522 . . . . 20.0 112.978 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -116.98 179.71 3.94 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.671 1.589 . . . . 20.0 111.396 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.28 168.4 19.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.218 0.914 . . . . 20.0 112.697 -175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.8 m -120.58 83.93 2.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.235 1.414 . . . . 20.0 108.897 174.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -98.78 155.65 36.45 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.669 1.188 . . . . 20.0 108.468 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.86 162.15 42.83 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.652 2.235 . . . . 20.0 111.184 173.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -62.23 -28.42 69.68 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.7 1.2 . . . . 20.0 111.329 173.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -73.2 -16.14 61.43 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.719 1.208 . . . . 20.0 113.818 175.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -97.39 -66.27 0.91 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.415 1.086 . . . . 20.0 110.34 175.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.6 m -72.0 143.18 86.11 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.876 0.87 . . . . 20.0 111.234 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.21 173.38 13.09 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 124.384 3.389 . . . . 20.0 111.178 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -74.04 7.77 2.47 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.564 1.546 . . . . 20.0 113.841 -172.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -123.54 -38.13 2.57 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.624 1.97 . . . . 20.0 112.699 -172.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.59 -15.4 63.41 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.339 1.056 . . . . 20.0 113.304 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.77 109.86 3.54 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 126.118 1.767 . . . . 20.0 110.421 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.35 169.58 17.37 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.393 1.477 . . . . 20.0 111.683 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -103.22 -6.64 21.9 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.103 1.361 . . . . 20.0 112.813 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.44 176.07 1.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.881 1.672 . . . . 20.0 111.215 167.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.34 174.49 22.85 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 123.865 0.745 . . . . 20.0 113.6 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.03 -4.42 20.5 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 126.182 1.849 . . . . 20.0 114.384 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.3 m -73.22 -177.52 2.56 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.68 1.24 . . . . 20.0 111.471 165.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.1 m -99.52 -10.69 21.82 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.813 0.845 . . . . 20.0 111.899 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.4 p -138.95 -70.68 0.41 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.955 1.702 . . . . 20.0 109.513 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -157.47 144.37 9.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.117 1.367 . . . . 20.0 109.186 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.45 132.92 35.34 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.482 0.713 . . . . 20.0 109.619 173.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.8 t -126.19 114.93 18.98 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.961 1.304 . . . . 20.0 109.613 -174.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -67.38 99.83 0.77 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 124.788 1.235 . . . . 20.0 110.106 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.4 mt -68.73 -27.89 66.33 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.303 1.041 . . . . 20.0 112.149 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -72.98 -10.12 59.46 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.053 1.341 . . . . 20.0 112.957 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mttt . . . . . 0 CA--C 1.539 0.549 0 C-N-CA 125.613 1.565 . . . . 20.0 111.175 174.35 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.534 0.346 0 N-CA-C 110.173 -0.306 . . . . 20.0 110.173 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 161.63 -15.79 0.16 Allowed Glycine 0 CA--C 1.534 1.277 0 CA-C-O 118.63 -1.094 . . . . 20.0 114.468 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.98 176.4 37.98 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.618 1.209 . . . . 20.0 113.449 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -145.59 157.64 43.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.61 1.164 . . . . 20.0 110.924 177.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.5 t -86.62 22.5 1.89 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.422 2.289 . . . . 20.0 112.127 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -58.93 148.91 68.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.893 1.277 . . . . 20.0 111.049 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.75 166.09 28.75 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 124.242 3.295 . . . . 20.0 113.469 -166.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.72 -23.85 65.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.378 1.071 . . . . 20.0 112.605 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -71.92 -13.03 61.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.261 1.424 . . . . 20.0 113.085 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.3 tpt85 -78.71 153.52 30.82 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.518 1.127 . . . . 20.0 110.269 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -102.68 101.63 11.76 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.533 1.133 . . . . 20.0 109.443 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 p -169.63 161.44 9.43 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.176 1.79 . . . . 20.0 111.077 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -80.88 110.14 16.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.087 1.755 . . . . 20.0 111.447 -173.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -79.6 151.41 30.63 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.46 0.704 . . . . 20.0 110.573 168.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.79 16.48 2.5 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.895 1.678 . . . . 20.0 114.54 175.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 51.85 21.37 1.42 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 130.251 3.42 . . . . 20.0 116.989 169.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -129.3 -71.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.271 1.429 . . . . 20.0 110.402 -167.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -63.47 -36.69 84.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 20.0 111.23 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.2 t -69.12 -32.03 71.15 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.18 1.792 . . . . 20.0 113.441 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.35 -7.06 16.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.009 1.324 . . . . 20.0 114.341 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.8 m -59.65 -42.6 93.16 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.227 1.411 . . . . 20.0 111.844 171.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 19.4 m -79.13 -11.47 59.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.839 1.256 . . . . 20.0 113.331 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 88.57 -98.83 2.47 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 125.319 1.438 . . . . 20.0 111.467 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -132.08 161.5 33.1 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.749 1.619 . . . . 20.0 110.588 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.63 -8.3 74.31 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.965 1.269 . . . . 20.0 113.598 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -123.75 178.61 5.15 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.849 1.66 . . . . 20.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -146.18 162.89 37.02 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.134 1.774 . . . . 20.0 110.537 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.65 123.27 17.45 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 107.738 -1.208 . . . . 20.0 107.738 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.1 t -140.03 105.83 5.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.272 0.629 . . . . 20.0 109.875 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.981 1.312 . . . . 20.0 109.345 179.855 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 N--CA 1.463 0.186 0 CA-C-O 119.351 -0.357 . . . . 20.0 111.487 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.2 m -61.92 -34.89 76.89 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.477 0.711 . . . . 20.0 111.392 176.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.29 -49.55 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.282 1.433 . . . . 20.0 110.367 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 t -63.89 -33.41 75.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.98 1.312 . . . . 20.0 112.455 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -82.4 -8.25 59.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.52 1.528 . . . . 20.0 113.104 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.29 15.32 41.69 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.558 1.075 . . . . 20.0 114.512 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -100.34 -177.57 3.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.052 1.741 . . . . 20.0 111.695 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.3 170.08 15.62 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.28 1.419 . . . . 20.0 112.525 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.6 m -113.62 78.84 1.18 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.006 1.322 . . . . 20.0 109.834 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.13 156.78 74.07 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.972 0.909 . . . . 20.0 109.491 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.05 161.65 45.19 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.771 2.314 . . . . 20.0 110.694 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -64.06 -29.92 71.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.898 0.879 . . . . 20.0 111.17 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 t -62.66 -36.15 81.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.613 1.165 . . . . 20.0 112.542 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -86.89 -58.09 2.73 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.943 0.897 . . . . 20.0 111.047 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.9 t -67.42 118.48 57.1 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.955 1.302 . . . . 20.0 110.978 -176.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -71.46 162.25 42.9 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.321 2.681 . . . . 20.0 110.845 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.52 -14.69 61.26 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.427 1.091 . . . . 20.0 113.461 -166.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.38 -34.04 65.34 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 128.226 2.61 . . . . 20.0 112.244 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.12 -6.43 38.44 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.197 1.799 . . . . 20.0 114.104 -173.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.52 105.53 3.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.079 0.951 . . . . 20.0 110.434 177.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.36 169.44 12.31 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.494 . . . . 20.0 111.808 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.3 t -93.8 -15.04 25.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.781 1.233 . . . . 20.0 112.677 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 22.9 m-85 -63.57 170.61 3.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.703 1.601 . . . . 20.0 111.491 170.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -147.25 -178.65 22.69 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.134 0.874 . . . . 20.0 113.587 -176.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.66 -13.18 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.627 2.061 . . . . 20.0 113.65 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 87.8 m -69.32 176.29 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.57 1.548 . . . . 20.0 112.909 179.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.3 t -90.64 -15.68 30.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.65 0.78 . . . . 20.0 111.077 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.4 p -137.69 -74.78 0.41 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 20.0 109.65 -176.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -161.98 161.06 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.236 1.814 . . . . 20.0 108.525 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.8 m -92.29 162.55 14.24 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.435 0.694 . . . . 20.0 110.965 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -146.85 121.15 9.58 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.013 0.925 . . . . 20.0 109.378 177.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -70.79 92.74 0.91 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.944 0.897 . . . . 20.0 111.563 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -64.11 -30.26 71.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.842 1.257 . . . . 20.0 112.485 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.7 p -71.23 -7.72 48.74 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.943 1.697 . . . . 20.0 113.507 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 77.1 mttt . . . . . 0 CA--C 1.536 0.416 0 C-N-CA 125.387 1.475 . . . . 20.0 112.862 -179.683 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp . . . . . 0 CA--C 1.539 0.555 0 N-CA-C 113.852 1.056 . . . . 20.0 113.852 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.1 -22.37 36.9 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.612 1.577 . . . . 20.0 114.012 174.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.67 173.97 43.73 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.677 1.608 . . . . 20.0 114.183 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -138.16 169.06 18.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.144 1.378 . . . . 20.0 112.99 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 12.0 t -95.8 33.91 1.6 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.032 2.133 . . . . 20.0 112.164 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.44 156.11 44.05 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.633 1.573 . . . . 20.0 112.895 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.46 159.42 44.4 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.711 3.607 . . . . 20.0 112.08 -171.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.2 -21.14 64.88 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.019 1.328 . . . . 20.0 112.518 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.29 -25.33 66.8 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.743 1.617 . . . . 20.0 112.836 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.55 150.97 42.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.817 1.247 . . . . 20.0 110.536 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -134.02 102.47 5.43 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.906 1.282 . . . . 20.0 109.188 -179.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.39 -87.73 0.08 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.444 1.897 . . . . 20.0 107.739 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -146.57 165.82 28.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.203 1.801 . . . . 20.0 109.302 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.96 163.53 32.72 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.977 0.911 . . . . 20.0 111.238 170.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.2 tp -169.23 109.92 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 107.498 -1.297 . . . . 20.0 107.498 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -67.1 -18.93 65.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.305 1.442 . . . . 20.0 114.147 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.7 -27.7 66.67 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.005 1.113 . . . . 20.0 114.005 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -127.5 -30.56 2.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.767 1.227 . . . . 20.0 111.832 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 54.7 p -70.46 -22.65 62.66 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.894 1.072 . . . . 20.0 113.894 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.28 -6.38 6.79 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.617 1.567 . . . . 20.0 114.412 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m -126.45 67.81 1.23 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.552 1.541 . . . . 20.0 109.401 167.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.86 -27.72 2.06 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.002 1.321 . . . . 20.0 113.934 171.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.62 -92.15 0.23 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 124.836 1.207 . . . . 20.0 111.923 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -77.13 41.33 0.29 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.97 2.108 . . . . 20.0 112.828 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.72 60.07 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 C-N-CA 123.75 0.69 . . . . 20.0 113.429 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -86.03 79.76 9.07 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 123.069 1.414 . . . . 20.0 111.314 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.66 119.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 128.395 2.678 . . . . 20.0 110.031 166.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -72.72 88.37 1.29 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.056 0.455 . . . . 20.0 110.807 176.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 26.4 t -81.53 132.77 35.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.459 1.904 . . . . 20.0 110.263 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.2 p . . . . . 0 CA--C 1.54 0.589 0 C-N-CA 123.523 0.729 . . . . 20.0 110.379 174.026 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 . . . . . 0 N--CA 1.462 0.145 0 CA-C-O 119.393 -0.337 . . . . 20.0 110.3 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.7 m -62.74 -36.47 83.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.708 1.203 . . . . 20.0 111.523 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.14 -43.49 95.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.508 1.523 . . . . 20.0 110.013 174.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 t -62.6 -38.41 90.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.082 0.953 . . . . 20.0 111.839 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -70.75 -30.07 66.48 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.484 1.114 . . . . 20.0 112.16 176.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.72 -2.23 23.17 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.771 1.653 . . . . 20.0 114.619 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -71.98 -179.15 2.63 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.349 1.86 . . . . 20.0 112.277 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.81 171.9 18.43 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 124.785 1.184 . . . . 20.0 113.195 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -113.2 82.35 1.65 Allowed 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.68 1.592 . . . . 20.0 109.837 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -86.64 156.04 56.12 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.408 1.083 . . . . 20.0 109.253 173.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.31 164.69 34.88 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.741 2.294 . . . . 20.0 110.809 170.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -64.52 -25.61 68.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.757 1.223 . . . . 20.0 112.013 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 t -69.59 -36.39 76.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.287 1.035 . . . . 20.0 112.124 177.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -86.62 -52.84 5.3 Favored 'General case' 0 C--N 1.344 0.349 0 C-N-CA 124.151 0.98 . . . . 20.0 111.475 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.1 t -67.2 119.33 63.93 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 124.36 1.064 . . . . 20.0 110.497 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -69.45 158.42 57.43 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.807 2.338 . . . . 20.0 110.321 175.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -73.44 -16.34 61.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.357 1.063 . . . . 20.0 112.878 -165.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.55 -40.75 48.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.597 2.359 . . . . 20.0 111.772 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.23 -4.71 51.93 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.872 1.669 . . . . 20.0 113.833 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.94 107.9 5.57 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 124.275 1.03 . . . . 20.0 110.84 -179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.04 170.65 10.95 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.911 1.684 . . . . 20.0 112.196 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 t -99.78 -11.11 21.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.571 1.548 . . . . 20.0 112.55 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -65.24 174.61 1.98 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.226 1.811 . . . . 20.0 111.306 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.92 176.75 25.64 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.669 0.652 . . . . 20.0 113.406 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.07 -12.71 17.03 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.136 1.826 . . . . 20.0 113.862 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -69.01 175.86 3.49 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.725 1.262 . . . . 20.0 112.323 173.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.6 p -85.07 -22.85 28.8 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 124.529 1.132 . . . . 20.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 p -140.9 -67.71 0.41 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.086 1.354 . . . . 20.0 110.297 -170.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.7 147.47 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 125.179 1.392 . . . . 20.0 109.862 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.9 m -87.32 131.02 34.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.741 1.216 . . . . 20.0 110.129 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 t -124.6 127.55 47.54 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.517 1.127 . . . . 20.0 109.701 -174.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -76.75 80.95 3.36 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.903 0.881 . . . . 20.0 113.3 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.62 -26.82 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.531 1.532 . . . . 20.0 113.95 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.6 m -67.3 -18.68 65.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.347 1.059 . . . . 20.0 113.048 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 pttt . . . . . 0 CA--C 1.533 0.323 0 C-N-CA 125.78 1.632 . . . . 20.0 113.545 -176.32 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.1 mttt . . . . . 0 N--CA 1.468 0.466 0 N-CA-C 113.779 1.029 . . . . 20.0 113.779 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 137.61 20.3 0.55 Allowed Glycine 0 CA--C 1.53 0.998 0 CA-C-O 118.805 -0.997 . . . . 20.0 114.185 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.61 -161.19 3.68 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.536 1.541 . . . . 20.0 113.986 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -139.82 140.62 36.65 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.153 1.381 . . . . 20.0 110.593 -172.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.43 122.25 32.45 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.559 0.744 . . . . 20.0 109.956 165.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -137.45 154.97 75.68 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.81 2.044 . . . . 20.0 110.035 173.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.81 164.99 19.76 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.724 3.616 . . . . 20.0 114.409 -165.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.23 -15.04 30.53 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.163 1.385 . . . . 20.0 113.834 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -88.91 -6.55 57.22 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.425 1.49 . . . . 20.0 113.922 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -67.28 -22.26 65.66 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.588 1.155 . . . . 20.0 114.107 -170.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 67.06 1.8 2.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.458 1.903 . . . . 20.0 114.525 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -63.58 -87.83 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.26 1.824 . . . . 20.0 112.207 -175.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -153.79 161.45 42.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.634 1.974 . . . . 20.0 109.121 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -128.24 141.23 51.52 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.781 2.032 . . . . 20.0 109.684 176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 68.0 mt -139.7 105.22 5.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.518 1.927 . . . . 20.0 108.889 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -63.54 -20.85 65.96 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.822 1.192 . . . . 20.0 113.46 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.06 -15.96 60.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.814 1.246 . . . . 20.0 113.983 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -129.83 -44.88 1.18 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.712 1.205 . . . . 20.0 112.138 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 m -66.47 -28.98 69.01 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 125.202 1.401 . . . . 20.0 113.228 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.11 -14.97 58.53 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.4 . . . . 20.0 112.992 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.4 m -68.44 -51.02 48.26 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 125.533 1.533 . . . . 20.0 111.616 173.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 23.3 m -69.1 -26.75 65.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.922 0.889 . . . . 20.0 111.517 169.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.24 -179.06 19.36 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.729 1.633 . . . . 20.0 113.278 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.33 45.3 0.37 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.282 2.633 . . . . 20.0 113.194 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -143.49 -2.72 0.91 Allowed Glycine 0 CA--C 1.535 1.311 0 C-N-CA 126.972 2.225 . . . . 20.0 113.018 176.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -135.87 171.21 14.79 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.048 1.424 . . . . 20.0 111.297 176.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -144.34 120.44 10.77 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.308 2.243 . . . . 20.0 110.509 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -81.09 125.49 30.28 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.262 1.425 . . . . 20.0 112.027 -165.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 35.8 m -71.99 -12.58 61.3 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 115.006 1.484 . . . . 20.0 115.006 -179.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 124.454 1.101 . . . . 20.0 112.069 -173.91 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.593 0.59 . . . . 20.0 112.593 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -63.79 -33.9 76.7 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.993 . . . . 20.0 111.754 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -42.6 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 125.274 1.43 . . . . 20.0 110.843 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 t -59.52 -45.03 92.93 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.864 1.666 . . . . 20.0 111.889 -177.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -69.06 -13.06 62.22 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.808 1.243 . . . . 20.0 113.443 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.28 5.75 57.95 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 125.4 1.476 . . . . 20.0 114.036 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -81.01 177.29 9.15 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.271 1.028 . . . . 20.0 112.011 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.97 177.05 18.0 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.235 1.398 . . . . 20.0 112.222 -174.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.4 m -131.24 71.91 1.49 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.922 1.289 . . . . 20.0 110.27 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.87 159.21 83.52 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.832 1.253 . . . . 20.0 109.696 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.73 161.04 47.48 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.391 2.061 . . . . 20.0 110.65 172.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.61 -21.47 66.72 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.0 0.92 . . . . 20.0 111.779 176.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.4 m -71.01 -17.98 62.61 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.541 1.536 . . . . 20.0 114.167 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.76 -46.12 2.66 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.558 1.143 . . . . 20.0 111.319 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.4 t -66.61 119.03 59.93 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 123.53 0.732 . . . . 20.0 110.537 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -71.33 161.25 46.29 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.327 2.684 . . . . 20.0 110.477 175.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -76.12 -13.5 60.2 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.416 0.895 . . . . 20.0 113.416 -166.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.07 -42.76 62.72 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.701 2.4 . . . . 20.0 111.794 171.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.72 -9.46 59.43 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.231 1.413 . . . . 20.0 113.482 -175.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.68 102.77 2.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.805 1.242 . . . . 20.0 111.33 -177.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 mt -75.57 167.12 22.5 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.872 1.269 . . . . 20.0 112.166 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -87.67 -12.14 46.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 20.0 112.773 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.89 170.39 11.26 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.744 1.217 . . . . 20.0 111.912 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.12 177.76 17.23 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.113 1.34 . . . . 20.0 112.669 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.03 -8.63 25.23 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.854 1.692 . . . . 20.0 113.53 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.0 m -77.52 175.83 9.47 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.555 1.142 . . . . 20.0 112.42 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -114.2 -5.06 13.02 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.317 1.447 . . . . 20.0 111.99 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.8 p -137.33 -71.83 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.998 1.719 . . . . 20.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -163.65 153.18 2.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.084 1.754 . . . . 20.0 109.42 177.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.94 157.32 38.38 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.853 0.861 . . . . 20.0 111.823 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -153.29 119.1 5.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.009 0.924 . . . . 20.0 110.185 174.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -71.76 90.51 1.09 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.017 0.927 . . . . 20.0 112.587 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.93 -37.61 82.91 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.66 1.184 . . . . 20.0 112.681 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.2 p -73.84 -5.54 41.56 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.872 1.269 . . . . 20.0 113.774 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mtmt . . . . . 0 N--CA 1.469 0.503 0 C-N-CA 125.505 1.522 . . . . 20.0 113.116 179.972 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 118.934 -0.555 . . . . 20.0 111.518 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.13 68.54 1.46 Allowed Glycine 0 C--N 1.343 0.936 0 N-CA-C 109.788 -1.325 . . . . 20.0 109.788 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.88 165.26 48.64 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.142 0.877 . . . . 20.0 113.645 -174.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 0.6 OUTLIER -86.54 168.23 13.88 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.56 1.144 . . . . 20.0 111.541 -179.54 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 69.7 m -112.55 107.83 16.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.29 1.036 . . . . 20.0 110.27 175.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -129.09 159.14 70.39 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.953 2.101 . . . . 20.0 109.411 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.48 170.86 15.26 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.088 2.525 . . . . 20.0 113.07 -171.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.2 mt -54.14 -35.9 62.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.727 1.211 . . . . 20.0 112.479 169.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -79.84 4.89 15.16 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.81 1.644 . . . . 20.0 113.665 -175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -64.3 -13.23 48.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.186 1.394 . . . . 20.0 113.573 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? 72.29 2.69 4.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.048 2.139 . . . . 20.0 112.976 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 165.92 3.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.313 1.845 . . . . 20.0 111.064 167.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -139.44 92.1 2.55 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 123.922 0.889 . . . . 20.0 110.682 -172.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -154.88 -173.49 4.59 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.39 1.476 . . . . 20.0 110.058 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -55.98 152.58 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.184 1.394 . . . . 20.0 113.02 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -131.64 2.46 4.11 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.641 1.176 . . . . 20.0 112.381 -171.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.09 -78.33 0.18 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.139 1.376 . . . . 20.0 110.916 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -68.77 -33.11 73.34 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.885 1.274 . . . . 20.0 112.437 -175.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.1 m -62.16 -31.16 71.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.116 1.366 . . . . 20.0 112.251 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.5 -9.74 37.64 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 114.866 1.432 . . . . 20.0 114.866 -172.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.9 t -58.34 -16.7 15.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.682 1.593 . . . . 20.0 114.181 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -17.55 53.24 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.19 1.182 . . . . 20.0 114.19 -176.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 138.71 -81.02 0.27 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.027 0.822 . . . . 20.0 112.755 171.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.48 59.82 3.05 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.051 1.74 . . . . 20.0 111.965 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 48.93 23.95 4.0 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 129.863 3.601 . . . . 20.0 114.931 -176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -41.69 146.02 0.27 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 128.213 2.605 . . . . 20.0 112.715 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -135.46 133.38 38.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.552 -1.204 . . . . 20.0 109.704 -177.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.45 131.93 29.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 124.314 1.009 . . . . 20.0 110.961 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.9 t -138.9 20.93 2.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.993 1.317 . . . . 20.0 111.525 -171.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 95.3 t . . . . . 0 CA--C 1.534 0.36 0 C-N-CA 125.044 1.338 . . . . 20.0 109.776 170.786 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 112.999 0.74 . . . . 20.0 112.999 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.7 m -58.05 -52.48 65.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.033 0.933 . . . . 20.0 110.902 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.38 -36.23 77.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.956 1.702 . . . . 20.0 111.414 -176.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 t -64.84 -35.97 82.83 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.674 1.189 . . . . 20.0 111.99 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -77.78 -18.13 56.76 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.543 0.737 . . . . 20.0 111.895 174.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.19 -7.67 35.21 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 126.598 2.047 . . . . 20.0 113.144 177.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -70.4 174.74 5.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.94 1.696 . . . . 20.0 112.279 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.71 -176.5 14.46 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.996 1.284 . . . . 20.0 112.604 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.1 m -125.74 58.55 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.414 1.485 . . . . 20.0 110.758 -173.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.83 156.42 87.11 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 125.035 1.334 . . . . 20.0 110.015 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -70.9 162.73 41.63 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.595 2.197 . . . . 20.0 110.875 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -65.6 -16.62 63.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.572 0.749 . . . . 20.0 111.962 173.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.9 m -72.84 -28.61 62.64 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.506 1.522 . . . . 20.0 113.067 173.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -107.59 -47.87 3.54 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.533 1.133 . . . . 20.0 111.24 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.2 t -65.94 121.04 73.96 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.909 1.284 . . . . 20.0 109.776 172.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.81 170.18 18.45 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.54 2.827 . . . . 20.0 110.499 174.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -77.94 -10.73 59.73 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.658 0.985 . . . . 20.0 113.658 -171.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.8 pt-20 -85.34 -37.46 19.89 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.89 2.076 . . . . 20.0 112.316 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 -2.85 43.12 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.35 1.86 . . . . 20.0 113.657 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.94 97.97 4.12 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 124.571 1.148 . . . . 20.0 110.997 -174.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.89 168.34 13.78 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.967 1.707 . . . . 20.0 111.402 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -85.45 -15.26 43.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.626 1.17 . . . . 20.0 112.971 -177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -66.37 167.67 10.14 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.431 1.492 . . . . 20.0 112.056 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.49 178.44 19.98 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.873 1.225 . . . . 20.0 112.265 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.88 -11.73 29.65 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 125.47 1.509 . . . . 20.0 113.02 -176.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.3 m -67.16 176.33 2.23 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.367 1.467 . . . . 20.0 112.537 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.7 t -101.14 -12.43 18.79 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.722 1.209 . . . . 20.0 111.736 174.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -139.64 -74.04 0.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.939 1.696 . . . . 20.0 109.807 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -163.89 143.42 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 125.047 1.339 . . . . 20.0 109.802 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.7 t -74.26 139.52 44.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.137 0.975 . . . . 20.0 109.704 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -138.3 124.81 20.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.641 0.776 . . . . 20.0 110.712 -175.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -73.09 82.06 1.27 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.046 0.939 . . . . 20.0 112.45 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.44 -31.67 72.89 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.747 1.219 . . . . 20.0 113.134 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -71.85 -11.98 61.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.572 1.149 . . . . 20.0 112.832 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.6 mttm . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 125.8 1.64 . . . . 20.0 112.957 -178.579 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.1 ttpt . . . . . 0 CA--C 1.533 0.309 0 N-CA-C 114.916 1.45 . . . . 20.0 114.916 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 -11.98 70.15 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 126.25 1.881 . . . . 20.0 112.865 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.5 108.66 0.07 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.212 1.863 . . . . 20.0 113.389 174.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.37 179.21 5.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.549 1.14 . . . . 20.0 111.021 168.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.4 t -137.55 57.34 1.74 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.166 0.986 . . . . 20.0 110.686 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.4 159.25 74.07 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.956 1.702 . . . . 20.0 112.08 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.07 164.12 31.32 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.524 2.816 . . . . 20.0 113.117 -176.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.27 -16.23 64.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.855 0.862 . . . . 20.0 112.607 172.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -65.87 -25.63 67.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.176 1.39 . . . . 20.0 112.763 172.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -68.96 148.62 49.88 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.923 0.889 . . . . 20.0 111.089 -175.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.33 9.1 24.45 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.286 1.034 . . . . 20.0 113.272 -178.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.4 t -60.24 169.23 1.69 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.166 1.386 . . . . 20.0 112.011 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -146.39 114.57 6.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.696 1.998 . . . . 20.0 108.354 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -152.96 176.18 12.14 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.291 0.567 . . . . 20.0 112.129 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -58.05 140.45 52.49 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.839 1.656 . . . . 20.0 112.847 174.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -75.32 -9.9 58.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.363 1.865 . . . . 20.0 114.235 174.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.29 -71.91 0.28 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.968 0.907 . . . . 20.0 110.858 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.472 ' H ' HD12 ' A' ' 57' ' ' LEU . 3.8 mm-40 -65.97 -28.11 68.65 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.114 1.366 . . . . 20.0 113.056 -178.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -66.6 -41.51 88.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.351 0.5 . . . . 20.0 112.351 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.14 -19.74 63.2 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.733 0.813 . . . . 20.0 112.212 174.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.2 m -90.74 -17.27 26.98 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.386 1.474 . . . . 20.0 112.86 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.98 -45.27 74.63 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 125.058 1.343 . . . . 20.0 110.241 176.303 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 142.33 175.4 15.59 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.292 0.948 . . . . 20.0 113.035 170.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -79.54 73.89 6.21 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.918 1.287 . . . . 20.0 109.204 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 162.32 -18.1 0.16 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.042 1.306 . . . . 20.0 113.127 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -146.57 174.42 11.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.534 1.533 . . . . 20.0 112.288 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -157.06 162.94 39.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.011 1.724 . . . . 20.0 112.122 -171.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -69.05 153.06 44.41 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 118.213 0.461 . . . . 20.0 110.481 169.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.9 t -152.56 159.07 43.3 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.384 1.474 . . . . 20.0 109.886 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.546 0.797 0 C-N-CA 127.104 2.161 . . . . 20.0 107.53 175.187 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 . . . . . 0 CA--C 1.531 0.249 0 N-CA-C 111.318 0.118 . . . . 20.0 111.318 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.0 t -65.28 -41.4 94.21 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.337 1.455 . . . . 20.0 112.098 -177.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 73.4 t -77.0 -40.18 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 20.0 110.822 176.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.9 t -62.46 -36.27 81.93 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.781 1.232 . . . . 20.0 112.628 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -76.04 -6.43 51.03 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 20.0 113.341 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.37 25.4 21.42 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.799 -1.001 . . . . 20.0 113.977 171.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -111.13 174.62 5.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.542 1.137 . . . . 20.0 111.594 -177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.79 178.03 16.57 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.033 1.302 . . . . 20.0 113.063 -171.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.9 m -123.51 69.33 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.242 1.417 . . . . 20.0 109.96 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mp -71.82 155.47 92.12 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 124.715 1.206 . . . . 20.0 109.29 171.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -72.01 162.01 43.1 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.162 2.575 . . . . 20.0 110.632 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -65.08 -24.38 67.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.209 0.604 . . . . 20.0 112.14 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -63.11 -39.43 94.68 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.689 1.196 . . . . 20.0 112.016 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -96.86 -47.8 5.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.412 1.085 . . . . 20.0 111.768 -176.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.13 118.12 36.42 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.36 1.464 . . . . 20.0 110.771 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -70.06 158.0 57.97 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.736 2.291 . . . . 20.0 110.355 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -77.84 -9.95 59.31 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.296 1.039 . . . . 20.0 112.708 -167.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.88 -37.71 39.5 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.306 2.242 . . . . 20.0 112.014 172.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.21 -5.05 55.46 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.413 1.485 . . . . 20.0 113.85 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -74.71 100.86 4.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.877 0.871 . . . . 20.0 111.523 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.6 mt -70.88 175.46 5.05 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.594 1.958 . . . . 20.0 112.605 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.4 p -99.75 -6.45 27.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.481 1.112 . . . . 20.0 113.56 177.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -72.34 172.83 9.64 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.328 1.051 . . . . 20.0 111.91 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.88 170.66 22.38 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.075 1.322 . . . . 20.0 111.684 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.54 12.41 3.39 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.176 1.369 . . . . 20.0 113.881 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 89.8 m -108.47 176.28 5.17 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 125.473 1.509 . . . . 20.0 111.856 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.1 m -110.31 -4.0 15.9 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.768 1.227 . . . . 20.0 111.912 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 p -137.16 -72.19 0.43 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.069 1.748 . . . . 20.0 109.634 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -160.12 143.24 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 124.681 1.193 . . . . 20.0 110.23 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.4 m -73.57 129.29 37.66 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 124.573 1.149 . . . . 20.0 110.245 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.3 t -131.11 113.55 14.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.434 1.094 . . . . 20.0 110.901 -174.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -63.52 108.24 1.32 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.992 2.117 . . . . 20.0 110.921 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.2 mt -83.04 -18.97 37.84 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.77 1.228 . . . . 20.0 113.272 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.5 p -78.75 -12.1 60.01 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.634 0.976 . . . . 20.0 113.634 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.485 0 C-N-CA 126.053 1.741 . . . . 20.0 112.813 171.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 tttm . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 114.459 1.281 . . . . 20.0 114.459 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.33 1.9 47.62 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.293 1.901 . . . . 20.0 112.916 -171.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.29 169.76 39.5 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 125.708 1.623 . . . . 20.0 114.201 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -153.54 -179.4 7.74 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.077 1.14 . . . . 20.0 114.077 -169.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.0 m -113.1 82.26 1.63 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.917 2.087 . . . . 20.0 109.981 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.8 165.88 29.94 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 125.204 1.402 . . . . 20.0 111.438 173.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -67.66 150.98 79.73 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.833 3.022 . . . . 20.0 112.807 -176.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.8 mt -63.96 -19.25 65.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.81 1.244 . . . . 20.0 112.409 171.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.34 -24.2 65.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.564 1.545 . . . . 20.0 111.928 174.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -84.71 128.35 34.56 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.282 1.033 . . . . 20.0 110.243 175.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -67.87 107.45 2.64 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.715 1.606 . . . . 20.0 111.276 -175.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.1 t -156.93 -170.26 3.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.273 1.829 . . . . 20.0 109.727 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -120.15 174.81 6.26 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.473 1.909 . . . . 20.0 109.995 175.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -136.27 161.38 35.92 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.505 1.522 . . . . 20.0 111.742 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -137.18 22.47 3.01 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.994 1.718 . . . . 20.0 114.439 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . 0.254 23.1 pt20 53.92 21.45 2.83 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 130.366 3.466 . . . . 20.0 116.912 166.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.75 -87.1 0.64 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.568 1.547 . . . . 20.0 109.977 -170.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -75.45 -27.05 58.76 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.577 0.626 . . . . 20.0 110.928 174.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.6 p -71.42 11.93 0.4 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.73 2.012 . . . . 20.0 113.877 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.04 -9.81 8.68 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.909 1.684 . . . . 20.0 112.775 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 t -86.33 -46.85 9.9 Favored 'General case' 0 C--N 1.345 0.395 0 C-N-CA 124.399 1.08 . . . . 20.0 113.122 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 5.0 m -66.54 -8.7 28.48 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.596 1.559 . . . . 20.0 115.083 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.27 164.76 33.17 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.755 1.645 . . . . 20.0 112.778 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -48.34 117.7 2.09 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.273 1.429 . . . . 20.0 112.087 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.07 8.4 11.66 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-O 118.248 -1.307 . . . . 20.0 113.009 -171.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.5 pm0 -105.36 153.49 21.58 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.467 1.634 . . . . 20.0 112.622 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 166.52 33.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.955 2.102 . . . . 20.0 109.486 162.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.6 t -128.09 133.69 49.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.072 0.949 . . . . 20.0 111.045 -175.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 82.6 m -133.81 77.89 1.74 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.331 1.452 . . . . 20.0 109.638 -168.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 39.9 t . . . . . 0 N--CA 1.462 0.167 0 C-N-CA 123.901 0.881 . . . . 20.0 108.81 -172.663 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 119.505 -0.283 . . . . 20.0 111.472 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.34 -56.33 23.51 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.964 1.306 . . . . 20.0 111.205 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.1 t -72.36 -28.25 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 125.643 1.577 . . . . 20.0 111.006 -178.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.3 t -66.72 -38.31 86.45 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.308 1.043 . . . . 20.0 111.685 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -75.05 -10.54 59.57 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.566 1.146 . . . . 20.0 112.886 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.71 1.16 62.01 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.841 1.21 . . . . 20.0 114.817 172.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -73.01 175.26 6.82 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.423 1.112 . . . . 20.0 111.561 175.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -106.32 166.91 13.97 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 124.873 1.225 . . . . 20.0 112.226 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -118.71 69.17 0.8 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.245 1.418 . . . . 20.0 109.202 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.18 156.18 90.9 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.99 1.316 . . . . 20.0 109.69 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.48 161.77 44.6 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.658 2.239 . . . . 20.0 111.215 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -63.54 -24.61 67.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.031 0.932 . . . . 20.0 112.148 177.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 p -65.99 -46.56 77.55 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.836 1.254 . . . . 20.0 111.982 173.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -80.77 -52.58 7.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.553 1.141 . . . . 20.0 111.558 -176.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.4 t -67.94 120.35 73.35 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.903 1.281 . . . . 20.0 110.657 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -69.31 161.49 45.66 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.316 2.677 . . . . 20.0 110.845 175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.71 -21.08 62.6 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.008 1.323 . . . . 20.0 112.696 -166.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.22 -39.46 59.98 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.877 2.471 . . . . 20.0 112.113 176.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.08 -5.21 55.48 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.083 1.353 . . . . 20.0 113.415 -177.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.98 102.39 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 124.291 1.036 . . . . 20.0 110.646 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.41 170.19 14.77 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.53 1.132 . . . . 20.0 111.983 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -91.91 -9.69 42.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.286 1.434 . . . . 20.0 112.698 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -71.41 159.88 33.75 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.693 1.197 . . . . 20.0 112.358 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -112.8 -179.5 19.49 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.7 1.619 . . . . 20.0 112.802 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.43 -5.75 41.4 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.382 1.467 . . . . 20.0 114.071 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.5 m -82.44 178.32 8.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.925 1.29 . . . . 20.0 112.524 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -114.57 -2.35 13.15 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.539 1.536 . . . . 20.0 111.649 175.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.8 p -138.64 -74.25 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.225 1.81 . . . . 20.0 109.841 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -166.74 143.61 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 126.526 1.93 . . . . 20.0 108.967 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.05 145.08 40.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.48 0.712 . . . . 20.0 110.265 173.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.09 118.66 14.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.854 0.861 . . . . 20.0 110.304 -176.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 93.13 0.33 Allowed 'General case' 0 C--N 1.346 0.417 0 C-N-CA 123.793 0.837 . . . . 20.0 111.665 178.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.31 -28.22 67.81 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.494 0.717 . . . . 20.0 111.65 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 t -78.38 -11.74 59.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.496 1.518 . . . . 20.0 113.226 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.7 mttp . . . . . 0 N--CA 1.467 0.418 0 C-N-CA 124.806 1.242 . . . . 20.0 113.465 -176.327 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm . . . . . 0 CA--C 1.536 0.427 0 N-CA-C 114.736 1.384 . . . . 20.0 114.736 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 6.96 66.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.029 1.776 . . . . 20.0 113.712 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.43 -161.05 4.36 Favored Glycine 0 C--N 1.343 0.947 0 C-N-CA 126.618 2.056 . . . . 20.0 114.021 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -130.53 171.45 13.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 122.95 0.5 . . . . 20.0 112.272 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.2 t -98.57 107.58 20.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.96 0.904 . . . . 20.0 110.421 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -137.21 156.51 75.38 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.878 2.471 . . . . 20.0 109.518 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.69 164.69 30.29 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.593 2.862 . . . . 20.0 113.494 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 69' ' ' LYS . 91.4 mt -61.55 -21.14 64.01 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.682 1.593 . . . . 20.0 112.702 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -98.8 9.9 42.41 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.843 1.657 . . . . 20.0 113.337 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.4 tpt85 -74.78 33.13 0.09 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.442 1.897 . . . . 20.0 112.985 175.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.28 -8.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 129.568 3.147 . . . . 20.0 114.459 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 59.3 m -74.29 148.84 41.07 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.554 1.542 . . . . 20.0 111.274 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -150.26 116.25 5.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.352 1.461 . . . . 20.0 110.493 173.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 5.3 tp10 -160.26 -173.97 4.29 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.328 1.451 . . . . 20.0 109.97 178.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.448 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.0 pp -56.94 158.47 4.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.252 1.821 . . . . 20.0 113.061 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -121.17 -0.52 9.93 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.931 2.092 . . . . 20.0 113.692 174.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.92 -9.56 39.48 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.748 1.619 . . . . 20.0 114.623 176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -135.07 -42.66 0.73 Allowed 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.208 1.403 . . . . 20.0 111.44 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.2 p -63.43 -16.45 60.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.356 1.462 . . . . 20.0 113.907 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.81 -2.3 0.53 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.011 2.124 . . . . 20.0 114.009 171.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m -56.97 -39.73 75.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.2 1.8 . . . . 20.0 112.748 172.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.5 t -76.46 -15.76 59.83 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 119.058 0.845 . . . . 20.0 112.684 173.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.45 -175.54 21.88 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 126.099 1.809 . . . . 20.0 111.365 -171.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -65.47 99.86 0.45 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.567 1.547 . . . . 20.0 109.642 175.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.07 -24.85 0.61 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.182 1.372 . . . . 20.0 112.832 -175.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -105.08 138.51 41.17 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.993 1.397 . . . . 20.0 111.672 -175.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD2' ' HA ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -133.48 138.64 46.25 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.838 2.455 . . . . 20.0 110.746 175.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.0 t -55.6 110.76 0.76 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.544 1.138 . . . . 20.0 111.428 -177.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.9 t -138.92 72.38 1.4 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 123.415 0.686 . . . . 20.0 112.348 -169.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.338 0.1 0 C-N-CA 124.749 1.22 . . . . 20.0 109.42 -178.971 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 . . . . . 0 N--CA 1.476 0.832 0 N-CA-C 110.443 -0.206 . . . . 20.0 110.443 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -100.44 -45.22 5.63 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.149 0.979 . . . . 20.0 110.802 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 79.8 m -65.25 -26.2 68.0 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.631 1.173 . . . . 20.0 112.996 -177.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.1 t -65.02 -52.77 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 125.057 1.343 . . . . 20.0 109.905 167.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.9 t -63.28 -30.84 71.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.866 1.266 . . . . 20.0 112.94 -176.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -86.66 -31.22 21.19 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.782 1.233 . . . . 20.0 111.942 177.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 94.25 58.88 1.19 Allowed Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.202 1.382 . . . . 20.0 113.324 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -127.44 -178.76 4.58 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.001 2.12 . . . . 20.0 111.25 174.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.91 178.83 32.4 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.27 1.414 . . . . 20.0 113.037 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 71.5 m -128.37 30.3 5.2 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.545 1.938 . . . . 20.0 112.239 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -58.6 148.11 67.67 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 124.111 0.965 . . . . 20.0 110.825 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -71.93 164.08 36.8 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.136 2.557 . . . . 20.0 111.841 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -60.07 -29.6 68.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.059 1.743 . . . . 20.0 112.221 179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.0 m -72.71 -35.19 67.53 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.179 0.992 . . . . 20.0 112.602 176.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -81.21 -65.65 0.99 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 124.14 0.976 . . . . 20.0 110.405 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 2.3 m -70.51 154.3 94.5 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 123.697 0.799 . . . . 20.0 111.359 175.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.24 173.39 14.59 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.694 2.929 . . . . 20.0 111.719 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -73.42 -18.56 61.13 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.065 1.346 . . . . 20.0 113.037 -174.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -90.7 -36.54 14.27 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 126.958 2.103 . . . . 20.0 112.877 -175.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.45 -9.74 57.27 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.505 1.522 . . . . 20.0 113.658 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -69.12 101.46 1.44 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.661 1.585 . . . . 20.0 110.702 -177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -72.22 164.02 26.96 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.672 1.189 . . . . 20.0 111.106 175.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.9 m -94.39 -11.35 30.08 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.084 1.353 . . . . 20.0 113.172 -175.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.436 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 24.1 m-85 -64.88 168.58 6.15 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.67 1.988 . . . . 20.0 112.278 177.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -123.89 -178.6 15.46 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.889 1.233 . . . . 20.0 113.935 -175.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.93 -16.47 54.3 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 126.833 2.159 . . . . 20.0 114.444 175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 57.1 m -73.07 -178.63 2.92 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.778 1.231 . . . . 20.0 112.65 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -94.7 -18.0 21.71 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.676 0.79 . . . . 20.0 111.958 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 p -142.1 -73.02 0.31 Allowed 'General case' 0 C--N 1.34 0.177 0 C-N-CA 125.455 1.502 . . . . 20.0 109.454 -173.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.1 p -156.51 148.64 11.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.574 1.549 . . . . 20.0 108.208 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 81.9 m -84.62 145.68 27.89 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.735 0.414 . . . . 20.0 110.217 173.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 45.2 t -134.49 120.87 20.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.557 1.143 . . . . 20.0 110.124 -175.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -70.34 88.43 0.64 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.69 1.196 . . . . 20.0 112.747 -178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.5 mt -66.1 -22.14 66.39 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.555 1.142 . . . . 20.0 112.571 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.1 m -65.68 -22.08 66.6 Favored 'General case' 0 C--N 1.344 0.366 0 C-N-CA 125.812 1.645 . . . . 20.0 112.6 174.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -127.35 4.81 6.29 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.595 1.558 . . . . 20.0 112.569 -170.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 20.1 tp -85.54 -41.91 14.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.061 1.744 . . . . 20.0 111.071 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 25.6 p -98.57 -80.55 0.46 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.563 1.545 . . . . 20.0 110.899 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 162.71 -127.26 1.67 Allowed Glycine 0 CA--C 1.526 0.777 0 C-N-CA 124.5 1.048 . . . . 20.0 111.124 -175.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.05 83.66 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.957 1.303 . . . . 20.0 111.629 -178.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -62.42 -24.62 67.51 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.145 1.778 . . . . 20.0 113.502 175.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -56.75 -35.47 67.86 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.313 1.435 . . . . 20.0 114.319 -172.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -121.42 -20.43 6.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.801 1.64 . . . . 20.0 112.692 171.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 141.77 -38.71 1.47 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 124.338 0.971 . . . . 20.0 112.365 167.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 170.64 46.66 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 124.333 0.968 . . . . 20.0 113.797 171.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -153.59 129.09 9.93 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 124.925 1.29 . . . . 20.0 110.369 -175.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 35.6 m -87.99 128.75 35.39 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.362 1.065 . . . . 20.0 109.121 162.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.35 159.15 73.0 Favored Pre-proline 0 CA--C 1.538 0.519 0 C-N-CA 126.016 1.727 . . . . 20.0 109.124 168.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.15 160.3 38.94 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 123.841 3.027 . . . . 20.0 112.723 -170.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.32 -20.64 64.56 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.243 1.017 . . . . 20.0 112.362 175.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.89 -28.29 65.52 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.917 1.687 . . . . 20.0 111.772 175.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.9 ttm-85 -99.45 111.64 23.96 Favored 'General case' 0 C--N 1.346 0.446 0 C-N-CA 124.448 1.099 . . . . 20.0 110.04 -176.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -73.98 116.31 14.46 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.331 1.453 . . . . 20.0 109.346 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 45.8 t -144.59 -91.54 0.1 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.666 1.187 . . . . 20.0 110.276 -170.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.431 ' HE3' ' HA ' ' A' ' 71' ' ' CYS . 22.2 ttpp -154.06 158.24 40.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.229 1.812 . . . . 20.0 109.646 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -131.68 133.08 44.49 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.841 1.256 . . . . 20.0 110.278 -176.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 24.9 tp -159.18 103.59 1.65 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.013 1.325 . . . . 20.0 110.144 -171.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -66.27 -6.69 14.73 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.96 1.704 . . . . 20.0 115.061 -176.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.95 78.99 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.324 1.05 . . . . 20.0 113.473 -174.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -137.24 -49.42 0.61 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.282 1.033 . . . . 20.0 111.337 -169.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.5 p -67.82 -10.23 51.12 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.106 1.151 . . . . 20.0 114.106 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -58.44 -20.57 46.04 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.617 1.339 . . . . 20.0 114.617 -177.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 90.7 p -125.13 34.59 4.94 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.836 1.254 . . . . 20.0 112.135 174.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.4 -13.8 59.36 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.633 0.975 . . . . 20.0 113.633 174.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.15 -103.23 0.89 Allowed Glycine 0 C--N 1.343 0.958 0 C-N-CA 125.349 1.452 . . . . 20.0 110.573 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -70.31 93.72 0.88 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.244 1.417 . . . . 20.0 109.474 173.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 94.88 60.18 1.09 Allowed Glycine 0 C--N 1.337 0.617 0 C-N-CA 124.502 1.049 . . . . 20.0 112.614 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -75.1 36.4 0.11 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.935 2.494 . . . . 20.0 114.858 177.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -119.75 99.46 6.66 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 126.664 1.986 . . . . 20.0 111.703 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -73.31 125.75 28.53 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.443 1.497 . . . . 20.0 110.962 173.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.431 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 80.5 m -127.5 135.66 50.68 Favored 'General case' 0 C--N 1.338 0.079 0 C-N-CA 125.828 1.651 . . . . 20.0 109.867 174.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.6 p -150.86 150.51 13.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.886 1.274 . . . . 20.0 108.993 175.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 7.0 m0 -135.51 -176.95 4.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.315 1.846 . . . . 20.0 110.514 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.67 -45.85 90.91 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.722 1.209 . . . . 20.0 110.979 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 72.1 m80 . . . . . 0 C--O 1.25 1.127 0 CA-C-O 116.654 -1.641 . . . . 20.0 111.911 173.9 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 41.8 m-20 . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 109.472 -0.566 . . . . 20.0 109.472 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -63.76 -31.76 73.04 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.627 1.171 . . . . 20.0 112.58 -175.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 96.0 m -53.58 -59.86 4.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.9 1.68 . . . . 20.0 110.946 170.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 48.8 t -64.3 -34.26 67.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 125.699 1.6 . . . . 20.0 111.387 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.6 m -68.78 -16.96 63.95 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.901 1.28 . . . . 20.0 112.925 179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.0 mmtm -102.29 -7.71 21.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.121 1.768 . . . . 20.0 112.139 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.7 0.08 52.61 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.335 1.922 . . . . 20.0 114.133 176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -86.32 177.09 7.58 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 126.042 1.737 . . . . 20.0 111.131 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.97 -176.54 16.42 Favored Glycine 0 C--N 1.341 0.81 0 C-N-CA 124.851 1.215 . . . . 20.0 113.229 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.2 m -130.31 76.57 1.73 Allowed 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.795 1.638 . . . . 20.0 109.304 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.09 162.02 75.81 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 125.103 1.361 . . . . 20.0 109.627 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -70.23 161.76 44.82 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.48 2.12 . . . . 20.0 110.457 170.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.73 -26.92 68.93 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.964 0.906 . . . . 20.0 111.469 171.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.4 m -69.73 -16.31 63.3 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.045 1.338 . . . . 20.0 113.582 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -122.34 -41.83 2.39 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.828 1.251 . . . . 20.0 111.825 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.6 t -67.63 119.46 66.11 Favored Pre-proline 0 CA--C 1.541 0.604 0 C-N-CA 123.878 0.871 . . . . 20.0 109.883 172.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.91 163.14 38.66 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.175 2.583 . . . . 20.0 111.276 176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.6 mt-30 -72.32 -3.56 24.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.788 1.635 . . . . 20.0 113.268 -170.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -100.27 -36.51 9.25 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 128.248 2.619 . . . . 20.0 111.846 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.51 -13.6 59.75 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.167 1.387 . . . . 20.0 113.589 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 89.7 mtt180 -67.02 120.87 14.37 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.888 1.275 . . . . 20.0 110.852 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.4 mt -86.81 178.83 6.88 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.855 1.262 . . . . 20.0 110.829 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.4 t -102.22 -1.31 31.53 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.242 1.417 . . . . 20.0 112.688 -179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -68.02 174.9 3.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.968 1.707 . . . . 20.0 113.398 178.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.24 -176.77 14.57 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.92 1.724 . . . . 20.0 112.812 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.89 -11.79 59.08 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 126.148 1.832 . . . . 20.0 113.422 -178.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 71.2 m -74.0 175.86 7.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.504 1.152 . . . . 20.0 112.78 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.7 m -106.27 -14.72 15.04 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.917 1.287 . . . . 20.0 111.938 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.2 p -138.01 -69.71 0.44 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.046 1.738 . . . . 20.0 109.985 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 p -157.12 156.11 4.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 C-N-CA 125.35 1.46 . . . . 20.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.4 t -79.47 161.46 26.05 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.979 0.912 . . . . 20.0 110.338 171.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -151.35 117.56 5.61 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 123.638 0.775 . . . . 20.0 110.793 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -70.75 98.77 1.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.643 1.577 . . . . 20.0 110.405 178.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 34.3 mt -79.59 -16.46 55.82 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.402 1.081 . . . . 20.0 113.19 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -71.11 -33.19 69.92 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.37 1.068 . . . . 20.0 111.455 -177.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -100.59 8.69 43.28 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.117 1.367 . . . . 20.0 112.959 177.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.6 tp -100.74 -39.54 7.78 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 126.077 1.751 . . . . 20.0 111.493 -178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.1 p -101.58 -97.92 0.27 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.01 1.324 . . . . 20.0 111.138 -175.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 159.34 -99.44 0.18 Allowed Glycine 0 C--N 1.343 0.96 0 CA-C-N 118.997 0.817 . . . . 20.0 111.978 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.1 m -69.21 -23.21 63.87 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.308 1.043 . . . . 20.0 112.352 176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 34.2 tttp 63.9 13.45 7.6 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.685 1.994 . . . . 20.0 113.881 173.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -92.97 -153.42 30.23 Favored Glycine 0 CA--C 1.533 1.219 0 C-N-CA 126.108 1.813 . . . . 20.0 112.179 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 44.0 mmtm -62.99 -25.36 68.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.502 1.521 . . . . 20.0 112.576 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 166.77 -35.2 0.23 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 124.617 1.103 . . . . 20.0 112.944 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.13 166.84 15.09 Favored Glycine 0 CA--C 1.532 1.095 0 C-N-CA 125.248 1.404 . . . . 20.0 113.99 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -151.03 167.49 27.5 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.767 1.227 . . . . 20.0 112.68 -172.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 93.8 m -87.23 66.14 9.1 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.421 1.488 . . . . 20.0 110.848 -178.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -71.75 158.45 87.77 Favored Pre-proline 0 CA--C 1.534 0.349 0 C-N-CA 124.252 1.021 . . . . 20.0 111.177 172.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.86 156.22 66.78 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 124.066 3.177 . . . . 20.0 112.092 -173.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.16 -20.63 65.58 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.58 1.152 . . . . 20.0 113.083 173.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -71.47 -15.16 62.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.714 1.606 . . . . 20.0 112.872 175.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.405 HH11 ' HB2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -80.9 139.8 35.7 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 20.0 110.201 178.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -80.5 101.83 9.34 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.796 -0.816 . . . . 20.0 108.796 177.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.416 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 0.5 OUTLIER -156.9 175.49 14.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.07 1.348 . . . . 20.0 109.995 179.55 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -76.91 159.12 30.26 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.697 0.799 . . . . 20.0 109.715 170.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -125.18 144.15 50.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.603 1.161 . . . . 20.0 110.117 172.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -131.6 170.71 14.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 127.403 2.281 . . . . 20.0 110.19 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -104.02 -4.07 23.79 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 126.059 1.744 . . . . 20.0 110.812 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.37 -82.46 0.08 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 126.101 1.76 . . . . 20.0 111.564 -177.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -75.2 -32.68 61.28 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.135 1.374 . . . . 20.0 112.542 -173.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.94 -25.04 67.71 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.511 1.124 . . . . 20.0 111.934 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.51 -19.82 63.72 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.355 1.062 . . . . 20.0 113.663 178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.8 m -66.53 -56.19 11.99 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.992 1.317 . . . . 20.0 110.269 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 83.1 m -70.83 -21.79 62.4 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.859 0.864 . . . . 20.0 112.01 173.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.47 -94.06 1.67 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 126.945 2.212 . . . . 20.0 112.736 172.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -138.48 164.04 30.4 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.782 1.633 . . . . 20.0 111.754 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 97.57 -16.82 59.93 Favored Glycine 0 CA--C 1.534 1.247 0 C-N-CA 124.926 1.251 . . . . 20.0 112.783 -170.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.08 178.5 4.88 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.988 1.715 . . . . 20.0 112.417 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HB3' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -150.32 156.21 41.1 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 128.579 2.751 . . . . 20.0 108.697 169.017 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 37.4 t -73.97 133.04 42.98 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.597 -0.52 . . . . 20.0 109.597 172.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.6 t -156.06 163.32 39.82 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.666 1.187 . . . . 20.0 110.351 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p -154.17 164.18 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 124.906 1.283 . . . . 20.0 110.588 176.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -130.77 -173.72 3.16 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.87 1.668 . . . . 20.0 112.497 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 21.3 tp -115.89 151.88 34.48 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.881 2.072 . . . . 20.0 109.529 176.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 73.8 t60 . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.387 2.275 . . . . 20.0 113.408 177.499 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 . . . . . 0 N--CA 1.474 0.769 0 N-CA-C 110.114 -0.328 . . . . 20.0 110.114 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -72.16 -43.83 64.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.963 0.905 . . . . 20.0 112.036 -174.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.75 -36.7 83.9 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.079 0.952 . . . . 20.0 111.983 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.3 t -68.44 -43.3 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.894 1.278 . . . . 20.0 110.513 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 75.0 m -62.57 -42.82 99.78 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.175 0.99 . . . . 20.0 111.967 177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.4 mmtt -66.13 -22.08 66.37 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.775 1.23 . . . . 20.0 112.663 175.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 100.0 3.34 55.87 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.513 1.53 . . . . 20.0 114.597 176.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -72.91 -179.53 3.23 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.425 1.49 . . . . 20.0 111.684 174.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.6 171.91 13.98 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.955 1.264 . . . . 20.0 113.382 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.08 63.38 0.79 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.715 1.606 . . . . 20.0 110.071 176.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.03 156.21 92.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 124.522 1.129 . . . . 20.0 109.874 175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -70.21 160.67 48.75 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.663 2.242 . . . . 20.0 110.6 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -63.59 -23.15 67.27 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.078 0.951 . . . . 20.0 111.385 173.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 35.3 t -59.87 -57.02 14.67 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.016 1.327 . . . . 20.0 111.039 171.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -85.58 -45.64 11.56 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.589 0.756 . . . . 20.0 111.436 -169.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.9 t -65.07 124.27 86.3 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.165 0.986 . . . . 20.0 110.416 177.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -69.09 161.58 45.26 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.915 2.41 . . . . 20.0 110.776 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -77.75 -0.46 27.07 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.934 1.294 . . . . 20.0 113.65 -169.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -102.79 -35.23 8.71 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 127.25 2.22 . . . . 20.0 112.521 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.95 -12.77 61.07 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.477 1.111 . . . . 20.0 113.638 175.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -66.99 121.21 15.05 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 124.773 1.229 . . . . 20.0 110.508 -178.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.3 mt -84.26 169.74 14.41 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.803 1.241 . . . . 20.0 112.569 -176.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.6 p -84.36 -16.54 42.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.205 1.402 . . . . 20.0 112.627 175.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -73.91 172.58 11.33 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.703 2.001 . . . . 20.0 111.809 178.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -131.78 -179.15 15.95 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.734 1.635 . . . . 20.0 111.775 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.23 25.18 1.69 Allowed Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.378 0.99 . . . . 20.0 113.845 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 94.6 m -128.29 -179.77 5.19 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.671 1.588 . . . . 20.0 111.8 -173.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.6 m -104.5 -11.78 16.84 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.749 0.819 . . . . 20.0 112.215 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 36.3 p -138.4 -66.81 0.48 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.922 1.289 . . . . 20.0 109.807 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.0 155.16 4.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.251 1.82 . . . . 20.0 108.934 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.8 m -82.65 160.1 22.52 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.035 0.534 . . . . 20.0 110.701 169.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.0 t -147.16 119.08 8.13 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 123.368 0.667 . . . . 20.0 110.051 178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -69.75 99.32 1.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.237 1.415 . . . . 20.0 110.262 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.6 mt -77.23 -13.55 59.92 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.249 1.02 . . . . 20.0 112.663 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.7 t -85.02 -16.11 41.87 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.647 1.579 . . . . 20.0 113.218 -177.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -137.02 17.37 3.01 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.88 1.272 . . . . 20.0 113.212 175.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.18 -40.78 91.19 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.653 1.181 . . . . 20.0 111.52 177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.2 t -135.55 167.58 20.82 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.103 1.361 . . . . 20.0 112.111 -171.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -164.38 -153.39 7.4 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 126.282 1.896 . . . . 20.0 111.486 -174.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 11.4 t -55.53 -61.42 2.36 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.085 1.354 . . . . 20.0 110.489 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -66.38 -13.33 60.5 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.043 1.737 . . . . 20.0 114.008 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -76.4 -5.27 81.81 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 124.599 1.095 . . . . 20.0 114.288 177.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -124.9 -17.09 5.93 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.406 1.882 . . . . 20.0 113.218 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 124.54 35.39 0.65 Allowed Glycine 0 CA--C 1.531 1.038 0 C-N-CA 125.196 1.379 . . . . 20.0 111.912 -175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.16 157.47 27.68 Favored Glycine 0 CA--C 1.53 1.008 0 C-N-CA 125.139 1.352 . . . . 20.0 113.637 -173.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -146.32 155.84 42.92 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.894 1.278 . . . . 20.0 109.822 -175.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 18.8 t -106.55 111.91 24.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.794 1.638 . . . . 20.0 109.135 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.411 HD21 ' HB3' ' A' ' 71' ' ' CYS . 5.0 p30 -141.48 156.33 66.91 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 127.305 2.242 . . . . 20.0 110.291 -167.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.23 161.25 34.84 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.226 2.617 . . . . 20.0 113.497 -170.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.0 mt -67.07 -18.43 65.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.808 0.843 . . . . 20.0 112.238 174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -66.85 -22.39 65.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.066 1.747 . . . . 20.0 112.041 172.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.38 122.95 26.45 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.56 1.544 . . . . 20.0 109.138 174.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -69.93 104.06 2.41 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.587 1.155 . . . . 20.0 110.574 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 3.7 t -159.82 175.75 12.73 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.388 1.475 . . . . 20.0 110.296 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -78.38 141.38 38.41 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.672 1.189 . . . . 20.0 109.372 171.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.84 133.24 49.16 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.121 1.368 . . . . 20.0 109.172 173.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -133.22 122.16 23.55 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.393 1.877 . . . . 20.0 111.041 -170.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -64.43 -15.96 61.55 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.748 1.619 . . . . 20.0 114.129 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.34 -24.47 63.91 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.268 1.427 . . . . 20.0 113.793 177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -139.17 -37.68 0.51 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.672 1.189 . . . . 20.0 112.518 -168.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 41.8 t -64.42 -29.39 70.44 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.5 1.12 . . . . 20.0 112.447 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.57 -31.62 72.77 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.581 0.752 . . . . 20.0 111.711 172.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 43.0 m -79.58 -33.14 41.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.045 1.338 . . . . 20.0 111.972 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 21.7 m -63.87 -34.02 77.01 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.388 1.075 . . . . 20.0 111.47 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.68 170.84 47.25 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 125.728 1.632 . . . . 20.0 112.796 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.47 126.24 26.66 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.648 1.179 . . . . 20.0 111.627 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 114.23 -19.68 17.19 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 125.689 1.614 . . . . 20.0 113.298 -178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pm0 -138.44 177.32 7.97 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.222 1.809 . . . . 20.0 111.98 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -151.31 173.37 14.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.827 2.051 . . . . 20.0 111.492 -176.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.0 t -91.5 147.17 23.21 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.067 0.547 . . . . 20.0 109.779 163.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.411 ' HB3' HD21 ' A' ' 48' ' ' ASN . 49.9 t -144.0 161.17 39.45 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.758 1.223 . . . . 20.0 109.936 172.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 43.2 t -126.29 156.08 36.61 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 126.251 1.821 . . . . 20.0 109.033 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -127.94 -176.13 3.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.68 1.592 . . . . 20.0 112.043 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 8.6 tp -133.18 169.29 17.09 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.501 1.52 . . . . 20.0 109.467 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 . . . . . 0 C--O 1.251 1.147 0 CA-C-O 117.016 -1.468 . . . . 20.0 110.935 176.105 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 109.443 -0.577 . . . . 20.0 109.443 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -66.07 -40.73 91.12 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.799 0.839 . . . . 20.0 112.035 -174.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.3 t -62.32 -36.27 81.65 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.373 1.069 . . . . 20.0 111.97 -178.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 63.0 t -76.71 -41.99 33.81 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.49 1.516 . . . . 20.0 110.776 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 35.1 t -61.59 -44.16 97.53 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.182 1.393 . . . . 20.0 111.976 -178.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -68.25 -12.97 61.88 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.469 1.508 . . . . 20.0 113.164 176.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.43 1.28 56.7 Favored Glycine 0 CA--C 1.532 1.135 0 C-N-CA 125.145 1.355 . . . . 20.0 114.603 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -74.71 175.17 8.18 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.57 1.185 . . . . 20.0 112.09 -178.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -103.6 175.9 23.77 Favored Glycine 0 CA--C 1.528 0.905 0 C-N-CA 125.014 1.292 . . . . 20.0 112.399 -179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -132.77 65.77 1.58 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.599 1.559 . . . . 20.0 109.42 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.94 158.12 87.65 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.135 0.974 . . . . 20.0 110.028 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.34 165.49 30.32 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.183 2.589 . . . . 20.0 111.389 175.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -60.92 -32.47 71.96 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.205 0.602 . . . . 20.0 111.374 177.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.2 t -65.66 -45.69 82.0 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.096 0.958 . . . . 20.0 112.162 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.61 -49.85 10.73 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.024 0.93 . . . . 20.0 111.725 -177.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -67.64 124.94 90.52 Favored Pre-proline 0 CA--C 1.54 0.59 0 C-N-CA 124.193 0.997 . . . . 20.0 110.574 -179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -68.74 160.78 48.17 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 122.802 2.335 . . . . 20.0 110.25 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -73.09 -18.49 61.3 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.732 0.813 . . . . 20.0 112.735 -170.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.4 -41.17 33.89 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.98 2.112 . . . . 20.0 112.365 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -9.02 58.2 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.69 1.196 . . . . 20.0 113.488 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -70.5 113.7 7.88 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.518 1.127 . . . . 20.0 110.748 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 37.4 mt -84.88 170.74 12.82 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.187 1.395 . . . . 20.0 111.957 -177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 98.0 p -82.44 -13.64 56.43 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.337 1.055 . . . . 20.0 113.429 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -74.76 175.25 8.14 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.804 1.241 . . . . 20.0 112.591 -175.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -137.14 -176.93 14.66 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.35 1.452 . . . . 20.0 112.317 177.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.46 -4.73 33.04 Favored Glycine 0 CA--C 1.534 1.219 0 C-N-CA 125.508 1.528 . . . . 20.0 113.332 -174.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 90.8 m -78.9 176.33 9.7 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.663 1.185 . . . . 20.0 111.984 173.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.8 t -111.54 -6.86 14.36 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.238 1.415 . . . . 20.0 111.579 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.6 p -131.6 -75.42 0.52 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.165 1.786 . . . . 20.0 109.021 177.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.2 p -165.58 151.89 2.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 126.852 2.061 . . . . 20.0 108.358 -178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.6 m -67.8 154.71 40.95 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.388 0.675 . . . . 20.0 111.497 172.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.3 t -151.06 113.69 4.67 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 123.589 0.755 . . . . 20.0 110.132 174.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -69.57 102.72 1.9 Allowed 'General case' 0 C--N 1.343 0.288 0 C-N-CA 123.96 0.904 . . . . 20.0 110.165 178.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.5 mt -68.7 -22.28 64.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.189 0.996 . . . . 20.0 111.941 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 t -82.9 -7.0 59.7 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.823 1.649 . . . . 20.0 112.884 177.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.0 mtmt -124.64 11.31 8.5 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.243 1.417 . . . . 20.0 112.803 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.76 -40.93 46.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.156 1.382 . . . . 20.0 111.878 -179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.2 p -122.6 -69.63 0.82 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.685 1.594 . . . . 20.0 111.048 -172.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.3 -148.23 48.82 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.741 1.162 . . . . 20.0 112.592 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 71.7 m -60.68 -39.22 87.67 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.601 1.16 . . . . 20.0 112.04 171.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt 73.15 -4.11 2.27 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.679 3.192 . . . . 20.0 114.932 175.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -99.83 -17.21 26.32 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 118.743 -1.032 . . . . 20.0 114.244 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.6 mmtm -134.98 -36.88 0.81 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 125.25 1.42 . . . . 20.0 113.434 -178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.34 31.94 2.48 Favored Glycine 0 CA--C 1.532 1.138 0 CA-C-O 118.847 -0.974 . . . . 20.0 112.538 -170.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -110.67 179.41 20.17 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.714 1.626 . . . . 20.0 112.21 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.8 pt-20 -119.88 166.57 13.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.163 1.385 . . . . 20.0 112.323 -171.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 49.2 m -90.84 -43.14 10.23 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.268 1.027 . . . . 20.0 113.758 -173.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.68 171.03 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.217 2.207 . . . . 20.0 114.537 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.85 149.58 66.48 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.261 1.974 . . . . 20.0 110.713 175.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.58 -24.23 65.28 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.001 1.32 . . . . 20.0 113.076 177.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -78.11 -8.44 58.25 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.978 1.711 . . . . 20.0 113.076 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 164.73 26.0 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.587 1.155 . . . . 20.0 110.374 170.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -107.56 104.15 13.64 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 125.533 1.533 . . . . 20.0 109.265 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.3 m -158.78 167.67 28.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.957 1.703 . . . . 20.0 110.602 -177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 41.7 tttp -69.55 160.45 31.46 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.889 1.275 . . . . 20.0 111.818 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -133.22 114.26 13.61 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 126.247 1.819 . . . . 20.0 109.494 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.2 pp -136.29 103.38 5.28 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 125.955 1.702 . . . . 20.0 110.235 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -61.26 -12.16 12.25 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.635 1.974 . . . . 20.0 113.564 -173.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.35 -40.67 95.11 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.796 1.638 . . . . 20.0 113.325 175.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -119.74 -40.39 2.76 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.897 1.279 . . . . 20.0 111.429 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 52.3 p -70.52 -15.22 62.77 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.544 1.138 . . . . 20.0 113.911 -172.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.04 -6.8 18.65 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 114.534 1.309 . . . . 20.0 114.534 -178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 59.7 p -112.73 17.86 18.74 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.894 1.678 . . . . 20.0 113.572 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 39.8 m -67.27 -83.41 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.66 1.184 . . . . 20.0 111.286 174.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 111.2 -28.84 9.29 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.143 1.354 . . . . 20.0 114.399 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.1 ptpp? -136.11 35.84 2.8 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.303 1.441 . . . . 20.0 112.805 173.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -166.69 -45.86 0.02 OUTLIER Glycine 0 CA--C 1.523 0.532 0 CA-C-O 119.159 -0.801 . . . . 20.0 113.59 -178.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.55 25.63 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 129.003 2.921 . . . . 20.0 117.017 -172.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.07 129.42 46.61 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 126.949 2.1 . . . . 20.0 108.749 176.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.2 t -110.38 127.92 55.32 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.989 0.916 . . . . 20.0 109.279 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.7 t -129.59 120.85 25.97 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 125.113 1.365 . . . . 20.0 108.855 -174.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.2 t -135.49 110.85 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 124.974 1.309 . . . . 20.0 108.092 -171.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 6.5 m0 -80.71 -177.71 6.43 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.936 1.295 . . . . 20.0 111.238 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.2 mt -136.71 152.62 50.57 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.1 1.36 . . . . 20.0 110.269 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.8 m170 . . . . . 0 C--O 1.251 1.159 0 CA-C-O 116.776 -1.583 . . . . 20.0 111.237 175.867 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 64.7 m-20 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.345 -0.243 . . . . 20.0 110.345 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -114.96 -43.67 3.09 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 124.429 1.092 . . . . 20.0 111.768 -173.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 33.2 m -63.91 -39.1 93.4 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.915 -0.565 . . . . 20.0 111.431 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.0 t -66.89 -35.4 74.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.192 0.997 . . . . 20.0 111.132 174.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -65.61 -35.46 80.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.139 0.976 . . . . 20.0 112.106 178.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -79.55 -28.06 41.25 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.592 1.157 . . . . 20.0 112.326 176.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.75 -1.32 32.06 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 125.408 1.48 . . . . 20.0 114.126 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -70.22 176.67 3.73 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.387 1.475 . . . . 20.0 111.588 172.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.96 179.13 20.5 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 125.263 1.411 . . . . 20.0 113.234 -175.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.9 m -132.56 54.43 1.95 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.153 1.781 . . . . 20.0 110.423 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -65.57 159.92 64.12 Favored Pre-proline 0 CA--C 1.541 0.61 0 C-N-CA 125.367 1.467 . . . . 20.0 111.276 179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -68.92 158.31 58.42 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.463 2.109 . . . . 20.0 110.931 171.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -64.13 -24.65 67.77 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.451 1.1 . . . . 20.0 111.589 176.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.7 m -72.62 -19.53 61.44 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.222 1.409 . . . . 20.0 113.458 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -107.12 -54.34 2.49 Favored 'General case' 0 C--N 1.343 0.299 0 C-N-CA 124.758 1.223 . . . . 20.0 110.607 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.6 t -64.92 120.55 67.55 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 124.603 1.161 . . . . 20.0 110.259 176.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -68.46 165.55 28.68 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.977 2.451 . . . . 20.0 110.735 176.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -71.16 -14.62 62.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.904 0.882 . . . . 20.0 113.129 -170.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -85.18 -40.7 16.4 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.499 2.32 . . . . 20.0 112.432 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.06 -7.16 52.92 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.634 1.574 . . . . 20.0 113.613 -177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -72.57 107.68 5.21 Favored 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.458 1.503 . . . . 20.0 110.961 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -72.57 168.32 18.84 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.004 1.322 . . . . 20.0 112.139 177.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -89.48 -13.94 36.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.43 1.492 . . . . 20.0 112.75 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.43 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 27.6 m-85 -66.25 172.31 4.01 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.103 2.161 . . . . 20.0 111.992 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -138.97 -175.83 14.25 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.683 1.135 . . . . 20.0 113.18 -175.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 102.4 -11.29 56.74 Favored Glycine 0 CA--C 1.536 1.356 0 C-N-CA 126.115 1.817 . . . . 20.0 113.632 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.3 m -69.7 175.09 4.45 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.58 1.152 . . . . 20.0 112.782 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.5 p -100.06 -14.52 18.58 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.656 1.583 . . . . 20.0 111.84 -176.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 p -141.6 -72.57 0.33 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 126.917 2.087 . . . . 20.0 109.156 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.5 p -159.05 154.02 5.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.481 1.512 . . . . 20.0 108.703 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 67.9 m -72.45 161.15 31.19 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.883 0.473 . . . . 20.0 111.711 171.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.3 120.86 6.92 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.163 0.985 . . . . 20.0 109.988 171.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -70.24 92.84 0.8 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.052 0.941 . . . . 20.0 111.827 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.4 mt -64.8 -37.07 86.38 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.496 1.119 . . . . 20.0 112.182 -174.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.1 t -63.04 -31.61 72.79 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.494 1.118 . . . . 20.0 111.95 177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 mtpp -101.63 2.62 39.01 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.429 1.091 . . . . 20.0 113.396 -176.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -52.18 20.39 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.189 1.396 . . . . 20.0 110.934 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 37.5 p 36.78 82.49 0.02 OUTLIER 'General case' 0 C--N 1.342 0.256 0 C-N-CA 129.133 2.973 . . . . 20.0 113.285 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -73.81 172.1 51.42 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 114.086 -1.415 . . . . 20.0 112.436 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 74.1 m -108.72 -41.86 4.67 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.435 1.494 . . . . 20.0 111.274 -174.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -59.0 -36.17 74.46 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.828 2.051 . . . . 20.0 113.616 -175.216 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -65.65 -73.09 0.64 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.614 1.578 . . . . 20.0 113.027 -171.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.6 mptt -68.86 -24.84 64.4 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.654 1.182 . . . . 20.0 112.008 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 86.0 -26.25 6.24 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.475 1.988 . . . . 20.0 112.907 -172.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.17 -171.3 48.83 Favored Glycine 0 CA--C 1.533 1.161 0 C-N-CA 125.175 1.369 . . . . 20.0 114.066 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -129.3 176.58 7.83 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.447 1.499 . . . . 20.0 112.002 -178.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 53.0 t -108.46 101.48 10.65 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.007 1.323 . . . . 20.0 110.15 -174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -130.32 154.64 81.52 Favored Pre-proline 0 CA--C 1.543 0.705 0 C-N-CA 128.352 2.661 . . . . 20.0 110.945 -170.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -67.83 162.1 41.08 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.159 2.572 . . . . 20.0 113.221 -170.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.416 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 83.8 mt -66.39 -20.9 66.19 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.138 0.575 . . . . 20.0 112.142 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -69.37 -20.06 63.84 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.814 1.646 . . . . 20.0 112.391 174.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 tpp180 -68.46 144.59 54.61 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.371 1.068 . . . . 20.0 109.286 171.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 -90.1 100.82 13.57 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.306 0.642 . . . . 20.0 109.797 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -163.39 176.73 9.54 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.737 1.615 . . . . 20.0 111.014 -177.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.5 ttpt -117.44 109.94 17.38 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.038 1.335 . . . . 20.0 111.138 -171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' HA ' ' H ' ' A' ' 70' ' ' CYS . 1.8 pm0 -64.84 173.31 2.34 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 127.271 2.229 . . . . 20.0 114.507 -178.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.1 mt -147.41 129.87 15.83 Favored 'General case' 0 C--N 1.347 0.462 0 C-N-CA 126.578 1.951 . . . . 20.0 109.847 167.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -64.29 -12.49 42.09 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.505 0.928 . . . . 20.0 113.505 166.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.86 -70.86 0.43 Allowed 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.408 1.483 . . . . 20.0 110.969 167.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -85.31 -49.63 8.01 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.07 0.948 . . . . 20.0 112.865 -166.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 1.3 p -70.17 -7.01 38.41 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.615 1.166 . . . . 20.0 113.398 -174.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.79 -14.3 62.84 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.31 1.444 . . . . 20.0 113.663 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.9 t -64.8 -54.83 24.95 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.843 1.257 . . . . 20.0 112.584 -175.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.7 m -74.37 -15.44 60.93 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 118.709 -0.663 . . . . 20.0 112.322 174.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.39 -154.73 35.08 Favored Glycine 0 C--N 1.346 1.103 0 CA-C-N 119.382 0.992 . . . . 20.0 112.925 175.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -60.19 110.34 1.2 Allowed 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.224 1.41 . . . . 20.0 110.602 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 124.59 -0.1 8.59 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.517 1.532 . . . . 20.0 113.325 -175.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -119.96 149.1 42.67 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.567 1.547 . . . . 20.0 111.596 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.416 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 17.2 ptpt -141.34 151.23 43.39 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.779 2.031 . . . . 20.0 109.461 165.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.471 ' H ' ' HA ' ' A' ' 56' ' ' GLU . 8.5 t -63.67 132.28 50.61 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 109.369 -0.604 . . . . 20.0 109.369 172.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.3 t -157.17 115.09 3.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.778 0.831 . . . . 20.0 110.37 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.0 p -150.75 160.02 4.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.617 1.167 . . . . 20.0 111.029 170.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -126.4 -178.96 4.53 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.206 1.803 . . . . 20.0 112.342 -174.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.6 133.83 39.19 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.709 1.604 . . . . 20.0 107.83 173.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 31.2 m170 . . . . . 0 C--O 1.238 0.487 0 C-N-CA 126.846 2.059 . . . . 20.0 112.182 -172.877 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 110.1 -0.333 . . . . 20.0 110.1 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -64.68 -45.84 84.95 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.993 0.917 . . . . 20.0 110.827 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 39.1 m -64.28 -36.63 84.72 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.879 1.272 . . . . 20.0 112.876 -172.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.8 t -65.6 -46.03 90.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.186 1.394 . . . . 20.0 110.815 174.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 11.8 t -63.38 -40.87 98.42 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.736 1.614 . . . . 20.0 112.828 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.0 mmtt -69.96 -27.78 65.01 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.823 1.649 . . . . 20.0 112.924 177.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.15 41.72 2.96 Favored Glycine 0 CA--C 1.534 1.237 0 CA-C-O 118.586 -1.119 . . . . 20.0 113.61 175.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -120.86 175.27 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.519 1.528 . . . . 20.0 111.72 176.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 171.51 26.68 Favored Glycine 0 CA--C 1.527 0.833 0 C-N-CA 124.913 1.245 . . . . 20.0 113.678 -172.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.8 m -126.77 39.95 3.82 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.052 1.741 . . . . 20.0 111.318 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.74 153.84 20.44 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 124.622 1.169 . . . . 20.0 110.934 175.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.45 155.97 65.47 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.618 2.212 . . . . 20.0 111.358 176.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.64 -20.25 66.17 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.776 1.231 . . . . 20.0 111.696 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -76.16 -8.69 57.59 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.825 1.65 . . . . 20.0 113.224 173.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -118.21 -66.65 1.06 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.618 1.567 . . . . 20.0 110.542 -176.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.24 147.54 98.84 Favored Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 118.299 0.5 . . . . 20.0 112.04 -174.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.11 167.24 27.86 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 123.525 2.817 . . . . 20.0 111.147 -177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.52 9.99 8.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.973 1.709 . . . . 20.0 113.236 -170.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -121.45 -34.78 3.38 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 126.52 1.928 . . . . 20.0 113.193 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.04 -7.81 44.16 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.291 1.436 . . . . 20.0 112.973 173.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.1 mtt180 -71.03 108.29 4.52 Favored 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.611 1.564 . . . . 20.0 111.614 -175.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 49.8 mt -72.35 169.82 15.49 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.085 1.754 . . . . 20.0 112.797 -176.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 96.3 p -86.55 -17.71 33.35 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.152 1.381 . . . . 20.0 112.927 178.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -71.78 171.92 10.76 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.518 1.927 . . . . 20.0 111.913 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -132.99 149.71 19.64 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 125.313 1.435 . . . . 20.0 110.313 169.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 156.26 23.42 0.03 OUTLIER Glycine 0 CA--C 1.531 1.056 0 CA-C-O 118.633 -1.093 . . . . 20.0 114.004 -176.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 66.8 m -135.91 176.88 8.28 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.426 1.49 . . . . 20.0 112.115 -172.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.6 p -89.4 -19.59 25.0 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.461 1.104 . . . . 20.0 112.302 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.7 p -142.37 -66.39 0.39 Allowed 'General case' 0 C--N 1.342 0.263 0 C-N-CA 125.19 1.396 . . . . 20.0 110.747 -168.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.6 p -159.87 141.19 4.25 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.926 1.29 . . . . 20.0 109.466 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 79.4 m -78.64 104.44 9.25 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.625 1.17 . . . . 20.0 109.604 173.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.9 t -100.56 117.2 34.21 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.226 1.01 . . . . 20.0 110.819 -177.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 55.6 t0 -66.71 99.68 0.63 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.079 1.752 . . . . 20.0 110.503 179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.0 mt -74.49 -18.27 60.64 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.367 1.067 . . . . 20.0 112.943 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.4 t -72.37 -21.68 61.25 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.268 1.027 . . . . 20.0 112.822 -176.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.07 -2.72 16.84 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.031 1.732 . . . . 20.0 113.58 175.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.8 tp -89.87 -43.67 10.45 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.799 1.64 . . . . 20.0 111.196 -179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.1 p -103.3 171.16 7.53 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.612 1.565 . . . . 20.0 111.193 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 86.34 162.38 36.85 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 125.294 1.426 . . . . 20.0 112.424 -178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 39.0 t -64.35 -49.54 71.28 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.716 1.206 . . . . 20.0 110.722 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -70.48 -13.2 62.02 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.694 1.598 . . . . 20.0 114.008 176.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -65.51 -77.01 0.28 Allowed Glycine 0 C--N 1.343 0.948 0 C-N-CA 125.954 1.74 . . . . 20.0 111.977 -173.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 61.7 mttm -68.0 -25.09 65.23 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.257 0.623 . . . . 20.0 111.893 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 109.2 -7.91 32.89 Favored Glycine 0 CA--C 1.531 1.091 0 C-N-CA 126.662 2.077 . . . . 20.0 113.066 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.74 156.66 6.22 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.618 1.58 . . . . 20.0 112.531 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -92.41 140.19 29.83 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.038 0.935 . . . . 20.0 110.281 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.3 t -86.94 8.67 22.17 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.851 1.66 . . . . 20.0 113.092 -177.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -46.72 150.25 1.3 Allowed Pre-proline 0 CA--C 1.542 0.641 0 C-N-CA 128.389 2.676 . . . . 20.0 113.44 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -64.92 159.84 44.17 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 123.196 2.597 . . . . 20.0 112.849 -170.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.455 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 71.7 mt -62.49 -20.51 64.65 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.342 0.657 . . . . 20.0 112.501 170.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -78.45 -17.62 56.08 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.562 1.545 . . . . 20.0 113.24 178.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 158.01 33.02 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.642 1.177 . . . . 20.0 110.807 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -70.92 -9.28 57.48 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.807 1.643 . . . . 20.0 114.641 -174.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 35.9 m -60.07 154.93 18.11 Favored 'General case' 0 C--N 1.346 0.431 0 C-N-CA 125.336 1.454 . . . . 20.0 111.61 174.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -154.38 118.32 4.7 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.126 1.37 . . . . 20.0 110.687 176.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 6.8 tp10 -158.75 -168.67 2.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.248 1.419 . . . . 20.0 109.887 174.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.498 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 2.9 pp -59.7 158.35 10.36 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.962 1.705 . . . . 20.0 113.146 171.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -114.84 -10.28 12.38 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.694 1.598 . . . . 20.0 113.291 174.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.15 -56.26 24.35 Favored 'General case' 0 C--N 1.345 0.387 0 C-N-CA 124.058 0.943 . . . . 20.0 112.295 -176.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -85.6 -27.56 25.4 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.893 0.877 . . . . 20.0 112.362 178.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -64.48 -32.77 74.54 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.1 0.96 . . . . 20.0 112.668 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.87 -1.76 0.71 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.507 2.323 . . . . 20.0 115.921 -168.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 53.6 m -58.66 -22.7 57.6 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.87 1.268 . . . . 20.0 113.594 172.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.6 m -78.43 -8.44 58.49 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 119.758 1.163 . . . . 20.0 113.793 171.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 89.02 -73.77 2.1 Favored Glycine 0 C--N 1.343 0.935 0 C-N-CA 125.433 1.492 . . . . 20.0 112.306 172.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -133.43 151.64 51.83 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 126.182 1.793 . . . . 20.0 109.098 -179.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 64.0 42.45 98.23 Favored Glycine 0 CA--C 1.528 0.903 0 CA-C-O 118.344 -1.253 . . . . 20.0 113.772 176.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.19 157.92 40.45 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.896 1.278 . . . . 20.0 112.239 179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 50' ' ' LEU . 12.9 ptpt -166.12 132.9 2.63 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.55 1.54 . . . . 20.0 110.512 171.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.81 156.76 36.33 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.788 0.435 . . . . 20.0 111.207 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.5 t -164.99 13.62 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.736 0.814 . . . . 20.0 112.698 -170.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 16.1 t -60.78 139.22 20.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.037 1.335 . . . . 20.0 111.103 -169.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -110.35 -176.14 2.91 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.96 1.304 . . . . 20.0 113.347 -169.133 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.0 tp -114.82 -71.75 0.73 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.453 1.501 . . . . 20.0 109.779 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 52.9 t60 . . . . . 0 C--O 1.252 1.214 0 C-N-CA 125.727 1.611 . . . . 20.0 110.022 179.682 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 . . . . . 0 N--CA 1.476 0.855 0 N-CA-C 110.348 -0.241 . . . . 20.0 110.348 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -113.97 -50.72 2.81 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.023 0.929 . . . . 20.0 110.421 175.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.7 t -62.92 -42.75 99.9 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.588 0.755 . . . . 20.0 112.327 -175.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 89.6 t -71.33 -39.82 72.69 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 124.01 0.924 . . . . 20.0 110.796 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 25.4 t -63.04 -34.05 76.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.822 1.249 . . . . 20.0 112.899 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -74.39 -19.14 60.53 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.795 1.638 . . . . 20.0 112.706 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.37 14.59 35.04 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.945 1.26 . . . . 20.0 114.538 176.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -75.4 175.04 8.8 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.765 1.283 . . . . 20.0 112.231 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -119.5 1.95 13.97 Favored Glycine 0 C--N 1.343 0.962 0 N-CA-C 117.481 1.752 . . . . 20.0 117.481 -160.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.8 m 34.34 61.92 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.266 2.627 . . . . 20.0 113.69 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.5 157.05 87.13 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.296 0.638 . . . . 20.0 109.939 173.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.04 165.39 32.74 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.985 2.457 . . . . 20.0 111.156 174.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -59.87 -38.95 83.66 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.498 0.719 . . . . 20.0 110.664 176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 88.9 p -67.38 -10.05 47.38 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.009 1.724 . . . . 20.0 115.056 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -122.24 -45.05 2.24 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 124.753 1.221 . . . . 20.0 111.001 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 33.2 t -65.14 119.44 58.89 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 124.926 1.29 . . . . 20.0 110.331 175.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.15 155.09 72.19 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 122.357 2.038 . . . . 20.0 110.201 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -69.37 -19.68 63.83 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.215 1.006 . . . . 20.0 112.641 -167.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -74.97 -39.12 61.46 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 127.76 2.424 . . . . 20.0 112.675 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.47 -9.66 59.4 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.508 1.123 . . . . 20.0 113.459 179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -69.72 117.53 11.43 Favored 'General case' 0 C--N 1.345 0.38 0 C-N-CA 124.007 0.923 . . . . 20.0 110.528 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 mt -88.06 176.38 7.33 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.519 1.528 . . . . 20.0 111.46 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 97.3 p -105.45 -6.75 19.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.335 1.454 . . . . 20.0 114.004 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -69.97 172.54 7.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.712 1.205 . . . . 20.0 111.855 175.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -126.27 177.39 17.2 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.877 1.227 . . . . 20.0 112.771 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 109.14 -4.1 31.61 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.767 1.651 . . . . 20.0 114.397 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.3 m -77.4 179.85 6.2 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.233 1.413 . . . . 20.0 112.468 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.7 m -103.16 -11.95 17.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.4 1.08 . . . . 20.0 112.233 175.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 p -138.32 -71.98 0.41 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.055 1.742 . . . . 20.0 109.654 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -158.36 153.39 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 126.196 1.798 . . . . 20.0 108.724 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 60.9 m -74.26 155.04 38.68 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.519 0.728 . . . . 20.0 111.033 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.9 t -149.32 114.2 5.39 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.394 0.678 . . . . 20.0 110.526 176.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -70.27 108.58 4.25 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 124.496 1.118 . . . . 20.0 110.915 -178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.6 mt -75.63 -27.4 58.41 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.763 0.825 . . . . 20.0 113.088 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.8 p -73.95 -11.79 60.45 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.084 1.142 . . . . 20.0 114.084 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -124.95 20.44 8.33 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.075 2.15 . . . . 20.0 111.355 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.2 tt -128.36 -45.11 1.37 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 126.679 1.992 . . . . 20.0 109.387 -177.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 42.4 p -124.62 171.43 10.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 126.439 1.896 . . . . 20.0 110.935 177.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -150.98 -103.28 0.26 Allowed Glycine 0 C--N 1.341 0.837 0 C-N-CA 125.396 1.474 . . . . 20.0 110.246 -177.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.2 t -87.18 -64.88 1.08 Allowed 'General case' 0 C--N 1.343 0.305 0 CA-C-N 117.799 0.8 . . . . 20.0 110.565 176.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -139.26 -32.76 0.65 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 113.657 0.984 . . . . 20.0 113.657 -171.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 178.83 -67.68 0.08 OUTLIER Glycine 0 C--N 1.343 0.932 0 CA-C-N 119.363 0.983 . . . . 20.0 112.549 -179.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.2 mmtp -68.74 -26.31 65.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.281 1.032 . . . . 20.0 112.823 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.61 -43.04 1.15 Allowed Glycine 0 C--N 1.339 0.702 0 C-N-CA 125.262 1.41 . . . . 20.0 111.146 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.37 167.58 43.78 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.497 1.523 . . . . 20.0 112.459 -174.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.18 157.85 44.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.503 1.921 . . . . 20.0 110.819 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 86.3 m -82.06 109.36 16.31 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.152 0.981 . . . . 20.0 109.394 173.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -127.1 155.01 76.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 127.236 2.214 . . . . 20.0 109.971 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.45 164.78 27.25 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.981 3.121 . . . . 20.0 113.428 -168.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 48.6 mt -59.97 -28.85 68.01 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.518 0.727 . . . . 20.0 111.588 168.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.21 -18.51 65.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.696 1.598 . . . . 20.0 112.725 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 23.6 tpt180 -65.98 -30.47 71.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.621 1.168 . . . . 20.0 112.316 -178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.88 1.11 0.78 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.646 2.378 . . . . 20.0 115.612 173.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 31.6 p -65.59 167.76 8.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.805 1.242 . . . . 20.0 111.68 172.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -63.68 134.15 54.87 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.253 1.021 . . . . 20.0 110.018 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -131.96 172.55 12.2 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.611 1.165 . . . . 20.0 112.116 175.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -130.93 162.54 29.47 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 126.978 2.111 . . . . 20.0 110.979 172.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -88.02 -2.28 58.51 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.633 1.573 . . . . 20.0 113.336 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.29 -70.2 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.483 1.513 . . . . 20.0 110.742 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -83.98 -27.19 28.63 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.499 0.926 . . . . 20.0 113.499 -176.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.3 p -66.19 -21.94 66.33 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.14 -11.0 35.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.993 1.317 . . . . 20.0 112.685 173.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.6 t -107.34 -30.57 8.62 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.887 1.675 . . . . 20.0 112.198 171.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 75.0 m -61.61 -27.23 68.51 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.368 0.986 . . . . 20.0 112.516 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.5 166.77 42.81 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 125.249 1.404 . . . . 20.0 112.712 177.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -62.94 133.84 55.27 Favored 'General case' 0 C--N 1.34 0.162 0 C-N-CA 124.789 1.236 . . . . 20.0 111.067 -176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 95.27 -2.41 65.5 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.162 1.363 . . . . 20.0 113.353 -172.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -149.96 137.8 20.15 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 118.921 1.361 . . . . 20.0 111.814 -170.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.58 172.37 12.83 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.642 1.977 . . . . 20.0 112.146 -174.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 43.9 t -69.89 137.58 51.76 Favored 'General case' 0 C--N 1.346 0.446 0 O-C-N 122.009 -0.432 . . . . 20.0 109.976 167.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 4.6 t -138.27 168.33 19.96 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.783 1.633 . . . . 20.0 108.576 163.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.5 p -151.94 162.81 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 C-N-CA 123.169 0.587 . . . . 20.0 109.966 170.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -123.19 -178.79 4.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 125.429 1.492 . . . . 20.0 112.14 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 91.6 mt -103.29 154.38 19.43 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.598 1.159 . . . . 20.0 109.189 169.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 . . . . . 0 C--O 1.248 1.013 0 C-N-CA 124.867 1.267 . . . . 20.0 111.3 -176.104 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 51.7 m-20 . . . . . 0 N--CA 1.476 0.842 0 CA-C-O 121.345 0.593 . . . . 20.0 109.639 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -67.91 -40.59 83.38 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 124.713 1.205 . . . . 20.0 111.366 -173.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.4 t -70.65 -37.42 73.72 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.542 1.137 . . . . 20.0 112.239 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.6 t -69.31 -37.63 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.305 . . . . 20.0 110.709 177.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.2 t -58.28 -37.55 75.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.875 1.27 . . . . 20.0 112.075 178.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -77.77 -46.28 22.13 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.518 1.127 . . . . 20.0 111.575 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 74.59 63.63 2.56 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.419 1.009 . . . . 20.0 112.378 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -95.28 -102.26 0.16 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.57 1.548 . . . . 20.0 108.741 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.58 165.58 35.08 Favored Glycine 0 CA--C 1.528 0.903 0 C-N-CA 125.153 1.359 . . . . 20.0 111.416 179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 62.9 m -125.45 55.96 1.39 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.276 1.43 . . . . 20.0 110.132 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -66.42 154.74 90.13 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 124.074 0.95 . . . . 20.0 109.803 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -69.79 160.08 51.02 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 123.026 2.484 . . . . 20.0 110.408 170.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.9 -37.31 84.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.768 0.827 . . . . 20.0 112.074 -177.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.0 m -68.72 -21.69 64.38 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.781 1.03 . . . . 20.0 113.781 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -92.06 -51.13 5.34 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.503 1.121 . . . . 20.0 110.571 175.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 35.3 t -62.93 118.51 43.05 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 125.517 1.527 . . . . 20.0 110.941 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.01 155.57 69.13 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.382 2.055 . . . . 20.0 110.206 175.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -74.08 -16.26 61.04 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.627 1.171 . . . . 20.0 112.72 -165.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.55 -39.82 64.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.649 2.38 . . . . 20.0 112.239 170.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.16 -11.18 59.77 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.612 1.165 . . . . 20.0 113.455 -176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -67.54 112.68 4.83 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.806 0.842 . . . . 20.0 110.694 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.6 mt -78.12 175.99 9.62 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.368 1.867 . . . . 20.0 111.153 174.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.7 p -110.81 -0.25 17.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.719 1.608 . . . . 20.0 112.804 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -72.07 171.57 11.67 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.73 1.212 . . . . 20.0 111.906 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -129.69 141.84 13.02 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 125.032 1.301 . . . . 20.0 111.275 174.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 150.09 -14.69 1.0 Allowed Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.763 1.173 . . . . 20.0 114.101 176.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -77.72 -179.55 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.899 1.35 . . . . 20.0 112.371 172.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.1 t -107.02 -9.53 16.19 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.496 1.518 . . . . 20.0 111.766 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.3 p -137.54 -69.61 0.45 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 125.425 1.49 . . . . 20.0 110.158 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.2 p -159.26 144.32 6.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 20.0 109.86 174.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 92.4 m -72.99 120.33 18.48 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.537 1.535 . . . . 20.0 110.173 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.0 t -126.33 108.34 11.15 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.544 1.138 . . . . 20.0 110.607 -171.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -65.04 106.09 1.19 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.54 1.936 . . . . 20.0 111.29 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.2 mt -80.67 -18.2 48.77 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.934 0.894 . . . . 20.0 112.913 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.4 m -77.51 -10.57 59.56 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.761 1.225 . . . . 20.0 113.398 -175.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -114.98 0.18 13.6 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.05 1.74 . . . . 20.0 112.998 172.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.6 tp -86.74 -48.18 8.48 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 126.063 1.745 . . . . 20.0 111.065 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 75.4 p -76.9 170.91 15.64 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.634 1.574 . . . . 20.0 112.421 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 114.92 165.26 14.82 Favored Glycine 0 CA--C 1.53 0.971 0 C-N-CA 126.192 1.853 . . . . 20.0 112.272 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.78 -46.7 68.07 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.646 0.779 . . . . 20.0 110.516 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.1 pttt -84.02 -15.37 47.86 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.189 1.396 . . . . 20.0 113.117 175.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.72 -52.31 51.56 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 124.816 1.198 . . . . 20.0 111.561 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -88.99 -21.61 23.43 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.142 1.377 . . . . 20.0 112.5 170.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.6 -24.54 16.8 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.617 1.58 . . . . 20.0 114.094 176.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 64.53 -162.66 37.12 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 124.708 1.147 . . . . 20.0 114.275 173.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -120.99 141.35 50.81 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.121 1.768 . . . . 20.0 109.208 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.9 t -89.05 17.08 6.14 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.928 1.291 . . . . 20.0 113.153 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -43.9 153.02 0.43 Allowed Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 128.92 2.888 . . . . 20.0 114.378 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.85 161.87 44.28 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.618 2.878 . . . . 20.0 112.474 -177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.8 mt -63.62 -18.96 64.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.846 1.258 . . . . 20.0 112.272 172.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -69.45 -25.65 64.2 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.356 1.463 . . . . 20.0 112.577 178.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -69.95 160.59 31.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.183 0.993 . . . . 20.0 111.238 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -74.33 97.77 3.1 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.381 1.072 . . . . 20.0 110.896 178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 98.7 m -153.77 154.84 34.77 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.782 2.433 . . . . 20.0 109.07 174.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 23.8 ttpp -154.99 92.21 1.43 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.076 1.35 . . . . 20.0 110.394 175.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.483 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 3.5 tp10 -153.94 -174.7 5.06 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.191 0.996 . . . . 20.0 110.897 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.483 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.5 pp -57.07 158.46 5.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.965 1.706 . . . . 20.0 113.826 179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -118.56 -9.11 10.34 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.751 2.021 . . . . 20.0 112.654 175.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -20.0 65.0 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.053 1.341 . . . . 20.0 114.069 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -124.67 -17.92 5.79 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.344 1.458 . . . . 20.0 111.843 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.5 t -79.29 -20.94 46.76 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.978 1.311 . . . . 20.0 113.498 177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.01 -0.46 5.72 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.239 1.415 . . . . 20.0 114.449 -174.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 34.6 t -56.64 -45.01 81.85 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.75 1.22 . . . . 20.0 111.602 166.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.3 m -69.99 -6.41 33.12 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.485 1.114 . . . . 20.0 113.461 171.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.21 -166.62 14.57 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 125.714 1.626 . . . . 20.0 112.389 174.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -76.03 46.42 0.39 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 126.416 1.886 . . . . 20.0 110.537 168.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -150.33 3.99 0.57 Allowed Glycine 0 CA--C 1.531 1.043 0 C-N-CA 126.46 1.981 . . . . 20.0 113.329 -173.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -142.61 152.98 43.07 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.675 1.738 . . . . 20.0 110.817 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -132.49 147.98 52.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.582 2.353 . . . . 20.0 108.114 165.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.2 t -60.8 142.74 55.76 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.848 0.356 . . . . 20.0 111.074 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.9 t -158.17 4.66 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.038 0.755 . . . . 20.0 113.038 -171.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.4 p -79.02 160.54 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 125.347 1.459 . . . . 20.0 111.69 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -132.92 179.09 6.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.481 1.512 . . . . 20.0 113.539 -173.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.73 156.84 34.27 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.585 1.554 . . . . 20.0 111.023 168.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.8 t-80 . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.76 1.624 . . . . 20.0 109.189 172.213 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 61.1 m-20 . . . . . 0 N--CA 1.475 0.803 0 N-CA-C 110.455 -0.202 . . . . 20.0 110.455 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -73.89 -75.3 0.16 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.186 0.595 . . . . 20.0 110.698 176.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 31.9 p -68.46 -28.25 66.88 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 114.557 1.317 . . . . 20.0 114.557 -167.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.0 t -57.27 -49.34 80.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 124.544 1.138 . . . . 20.0 109.617 171.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.4 t -71.65 -27.26 62.95 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.733 1.213 . . . . 20.0 112.786 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mmmp? -67.52 -24.97 65.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.208 1.003 . . . . 20.0 112.419 175.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 119.23 -1.11 14.52 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 125.181 1.372 . . . . 20.0 114.176 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -77.95 172.14 13.93 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.753 1.277 . . . . 20.0 112.222 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -108.9 -7.04 29.73 Favored Glycine 0 C--N 1.341 0.839 0 N-CA-C 118.019 1.968 . . . . 20.0 118.019 -153.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 81.0 m 37.54 53.93 1.41 Allowed 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.801 2.44 . . . . 20.0 113.76 -171.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -63.55 154.25 80.27 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 123.166 0.587 . . . . 20.0 109.646 172.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -67.7 161.97 41.41 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.86 2.373 . . . . 20.0 111.256 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -65.64 -18.33 65.24 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.403 0.681 . . . . 20.0 111.604 175.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.7 m -68.29 -43.57 77.42 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.681 1.192 . . . . 20.0 112.231 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -89.4 -48.34 7.4 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.821 0.848 . . . . 20.0 112.285 -174.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.3 t -64.19 118.92 51.28 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 125.004 1.321 . . . . 20.0 110.683 -176.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -71.06 157.99 56.32 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.916 2.41 . . . . 20.0 110.042 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -73.26 -16.58 61.39 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.0 0.92 . . . . 20.0 112.954 -164.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -72.44 -40.47 67.05 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 128.174 2.59 . . . . 20.0 112.221 173.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 -6.78 59.51 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.615 1.566 . . . . 20.0 113.616 -176.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 -71.53 101.99 2.6 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 123.868 0.867 . . . . 20.0 111.036 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.4 mt -67.73 170.86 7.19 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.085 1.754 . . . . 20.0 111.178 172.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.6 t -110.47 -3.21 16.17 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.486 1.514 . . . . 20.0 112.984 -174.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -63.74 175.38 1.13 Allowed 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.243 1.817 . . . . 20.0 111.85 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -122.79 178.53 16.35 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.235 1.398 . . . . 20.0 112.754 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 108.06 -3.85 33.63 Favored Glycine 0 CA--C 1.533 1.206 0 C-N-CA 124.97 1.271 . . . . 20.0 115.085 171.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 82.7 m -77.48 176.38 8.94 Favored 'General case' 0 C--N 1.343 0.287 0 CA-C-N 119.196 1.498 . . . . 20.0 113.143 177.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -85.7 -17.67 35.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 114.728 -1.124 . . . . 20.0 110.84 166.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -143.08 -70.83 0.32 Allowed 'General case' 0 C--N 1.344 0.357 0 C-N-CA 125.428 1.491 . . . . 20.0 111.783 -168.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.1 p -164.88 137.38 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 C-N-CA 125.506 1.522 . . . . 20.0 109.412 -175.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.1 m -70.48 128.09 34.95 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.439 1.096 . . . . 20.0 109.491 173.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 4.8 t -130.89 114.71 15.61 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.574 1.149 . . . . 20.0 110.609 -172.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -67.11 121.4 15.53 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.327 0.584 . . . . 20.0 112.138 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.4 mt -97.47 -26.22 14.91 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.694 1.198 . . . . 20.0 112.164 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.2 m -68.55 -10.94 58.93 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.397 1.479 . . . . 20.0 114.187 -173.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 10.3 ptmm? -135.55 5.32 3.17 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.419 1.887 . . . . 20.0 113.17 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.32 -44.28 68.57 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.915 1.286 . . . . 20.0 111.892 -174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 41.1 p -110.16 -75.69 0.62 Allowed 'General case' 0 C--N 1.344 0.366 0 C-N-CA 124.976 1.31 . . . . 20.0 111.316 -174.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 152.54 -98.7 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 124.453 1.025 . . . . 20.0 111.438 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.43 -37.66 73.14 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.192 1.397 . . . . 20.0 112.634 -176.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -70.95 -9.31 57.66 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.952 1.701 . . . . 20.0 114.108 -174.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.15 -61.94 5.9 Favored Glycine 0 C--N 1.343 0.963 0 C-N-CA 124.558 1.075 . . . . 20.0 111.986 178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 55.9 mmtt -70.85 -21.9 62.38 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.858 1.663 . . . . 20.0 113.401 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 105.67 54.37 0.73 Allowed Glycine 0 CA--C 1.531 1.042 0 C-N-CA 124.559 1.076 . . . . 20.0 112.016 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -133.62 177.5 18.99 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 124.974 1.273 . . . . 20.0 113.357 174.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -140.32 157.53 45.42 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.563 1.545 . . . . 20.0 112.581 -179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 38.8 t -101.28 44.96 0.99 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 127.13 2.172 . . . . 20.0 111.185 -168.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -63.72 163.88 19.2 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 126.624 1.97 . . . . 20.0 113.49 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -67.31 163.46 34.36 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.824 3.016 . . . . 20.0 112.83 -177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 53.5 mt -68.04 -20.46 64.98 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.656 1.182 . . . . 20.0 112.003 171.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -62.99 -39.99 96.41 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.928 1.691 . . . . 20.0 111.031 175.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -74.37 132.45 42.01 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.305 1.042 . . . . 20.0 109.058 173.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -73.73 122.83 22.99 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 123.145 0.578 . . . . 20.0 110.062 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -168.7 166.44 11.71 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.401 1.48 . . . . 20.0 111.233 176.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.8 ttmp? -77.58 166.16 23.39 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.939 1.296 . . . . 20.0 110.665 174.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -132.6 140.65 48.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.449 1.499 . . . . 20.0 110.393 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.1 118.59 16.88 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.785 2.034 . . . . 20.0 110.885 -171.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -63.32 -17.45 62.56 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.986 1.314 . . . . 20.0 114.527 -173.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.76 -20.38 61.19 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.95 1.3 . . . . 20.0 113.834 178.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -139.32 -37.0 0.51 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.97 . . . . 20.0 112.286 -169.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 22.9 t -69.55 -21.55 63.62 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.749 1.219 . . . . 20.0 112.724 178.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.09 -8.78 18.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.888 0.875 . . . . 20.0 112.822 172.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.7 t -100.49 -26.76 13.74 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.288 1.435 . . . . 20.0 112.436 171.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 94.3 m -66.38 -44.64 82.57 Favored 'General case' 0 C--N 1.347 0.489 0 CA-C-N 119.178 0.899 . . . . 20.0 110.632 171.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 68.75 -179.27 22.87 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.603 1.097 . . . . 20.0 113.487 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -50.12 135.17 21.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.735 1.614 . . . . 20.0 112.398 -176.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 100.19 -28.58 15.08 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 126.194 1.854 . . . . 20.0 113.242 -175.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -142.51 -178.79 5.94 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.5 1.52 . . . . 20.0 111.734 -176.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 15.4 pttp -165.72 152.59 10.0 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.962 1.305 . . . . 20.0 111.361 -175.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -76.93 148.16 36.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.252 0.621 . . . . 20.0 110.128 166.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 20.2 t -149.21 140.82 23.44 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.918 1.687 . . . . 20.0 108.292 170.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 t -133.94 160.53 41.86 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 124.927 1.291 . . . . 20.0 109.257 -169.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -126.06 -178.21 4.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.077 1.351 . . . . 20.0 112.792 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.4 mp -122.41 -11.1 8.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.938 1.295 . . . . 20.0 112.729 -175.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 . . . . . 0 C--O 1.25 1.098 0 C-N-CA 125.175 1.39 . . . . 20.0 110.0 -175.805 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.4 p30 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.432 0.158 . . . . 20.0 111.421 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -127.17 -42.79 1.68 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.334 1.054 . . . . 20.0 111.876 -175.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 90.0 m -58.66 -38.51 78.3 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.269 0.627 . . . . 20.0 110.785 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.14 -43.26 95.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 125.489 1.516 . . . . 20.0 110.986 174.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.3 m -63.26 -36.25 83.05 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 124.408 1.083 . . . . 20.0 112.41 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.1 -12.06 60.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.875 1.27 . . . . 20.0 112.751 176.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.59 1.19 53.07 Favored Glycine 0 CA--C 1.535 1.31 0 C-N-CA 125.61 1.576 . . . . 20.0 115.008 173.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -79.54 179.92 7.2 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.61 1.564 . . . . 20.0 111.995 179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.1 174.91 15.44 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 125.603 1.573 . . . . 20.0 113.064 -176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.3 m -118.24 41.87 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.134 1.374 . . . . 20.0 112.054 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.13 143.9 97.49 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 122.976 0.51 . . . . 20.0 109.885 176.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -73.58 166.62 29.33 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.439 2.759 . . . . 20.0 112.797 -173.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -64.38 -25.74 68.16 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.564 1.545 . . . . 20.0 112.362 178.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.2 m -77.72 -12.85 60.01 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.435 1.494 . . . . 20.0 113.815 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -117.87 -66.97 1.03 Allowed 'General case' 0 C--N 1.344 0.351 0 C-N-CA 124.577 1.151 . . . . 20.0 110.513 -170.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -60.4 158.54 28.53 Favored Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 123.462 0.705 . . . . 20.0 112.075 176.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -83.13 170.13 12.38 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.847 3.031 . . . . 20.0 111.892 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -83.77 -5.65 59.25 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.335 1.454 . . . . 20.0 113.337 -173.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -90.75 -32.43 16.14 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.82 2.048 . . . . 20.0 112.196 179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.02 2.63 12.24 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.909 1.684 . . . . 20.0 113.672 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -85.7 102.73 13.87 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.221 1.008 . . . . 20.0 112.704 -165.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 43.1 mt -74.77 176.42 7.05 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.346 1.858 . . . . 20.0 111.721 175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.9 t -137.2 19.15 2.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.169 1.388 . . . . 20.0 113.226 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -63.06 -100.71 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.563 1.945 . . . . 20.0 111.176 171.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 155.16 177.8 28.8 Favored Glycine 0 CA--C 1.532 1.11 0 C-N-CA 128.178 2.799 . . . . 20.0 111.407 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 100.33 38.0 3.64 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 119.092 -0.838 . . . . 20.0 113.931 176.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 68.9 m -132.8 179.39 6.19 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.556 1.543 . . . . 20.0 111.171 176.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.1 m -108.65 -6.28 16.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.397 1.079 . . . . 20.0 112.284 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.1 p -136.77 -67.79 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.644 1.578 . . . . 20.0 109.852 174.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -165.81 163.2 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 C-N-CA 127.75 2.42 . . . . 20.0 107.946 -173.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 59.8 m -97.49 157.73 15.85 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.556 0.743 . . . . 20.0 111.727 173.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 13.3 t -146.34 118.22 8.18 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.418 1.487 . . . . 20.0 109.94 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.96 96.89 1.07 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.424 1.09 . . . . 20.0 113.215 -176.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 32.7 mt -69.26 -9.01 51.18 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.844 1.258 . . . . 20.0 113.585 179.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.1 t -101.1 -7.58 23.06 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.966 1.306 . . . . 20.0 112.795 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.3 mmtm -124.66 0.79 8.17 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.882 1.673 . . . . 20.0 112.898 -177.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.64 -36.44 57.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.978 1.711 . . . . 20.0 112.424 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 65.8 p -128.65 168.83 15.22 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.793 1.637 . . . . 20.0 111.481 -177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 147.15 -164.04 28.65 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 125.45 1.5 . . . . 20.0 111.1 -176.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.3 m -75.07 -65.18 0.91 Allowed 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.465 -0.432 . . . . 20.0 110.312 165.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.1 tmtp? 52.93 17.74 0.94 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.497 1.919 . . . . 20.0 114.262 -174.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -81.36 -153.32 10.22 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 126.214 1.864 . . . . 20.0 111.693 173.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.9 mtpm? -65.6 -32.19 73.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.256 1.022 . . . . 20.0 112.753 -177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 140.66 -14.48 2.92 Favored Glycine 0 CA--C 1.534 1.253 0 C-N-CA 125.395 1.474 . . . . 20.0 114.407 174.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.67 172.11 48.62 Favored Glycine 0 CA--C 1.53 1.015 0 C-N-CA 125.353 1.454 . . . . 20.0 112.745 -178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -136.8 171.34 14.64 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.591 1.556 . . . . 20.0 111.438 -178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 57.3 m -74.68 25.09 0.09 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.138 2.175 . . . . 20.0 114.565 -172.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -55.46 154.02 13.08 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 125.088 1.355 . . . . 20.0 111.116 172.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -73.44 163.11 38.52 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.553 2.835 . . . . 20.0 111.782 -174.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.1 mt -69.76 -13.89 62.51 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.08 1.352 . . . . 20.0 112.512 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -68.87 -31.78 70.97 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.209 1.404 . . . . 20.0 111.825 174.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 54.2 ttt180 -72.39 135.05 45.74 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.596 0.758 . . . . 20.0 109.82 178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -80.84 104.28 11.25 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.362 1.465 . . . . 20.0 110.952 -176.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.47 ' HB2' ' HE2' ' A' ' 69' ' ' LYS . 1.3 m -162.04 165.55 27.13 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.466 1.906 . . . . 20.0 110.274 178.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -68.48 162.11 26.29 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.37 1.068 . . . . 20.0 111.671 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -133.96 125.11 27.51 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.406 1.482 . . . . 20.0 110.855 -173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.9 pp -129.26 170.96 12.96 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 127.319 2.247 . . . . 20.0 110.817 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -113.67 -5.4 13.36 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.762 1.225 . . . . 20.0 112.018 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.6 -34.72 62.89 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.56 1.544 . . . . 20.0 113.131 -173.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -138.34 -36.71 0.58 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.422 1.489 . . . . 20.0 111.855 -178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.6 p -90.12 48.47 1.57 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.079 1.752 . . . . 20.0 110.441 -176.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -130.06 -7.68 4.38 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.635 1.974 . . . . 20.0 111.98 177.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.7 m -133.8 84.44 2.12 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 124.769 1.228 . . . . 20.0 111.354 -176.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.5 t -141.12 -55.72 0.49 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.034 0.753 . . . . 20.0 113.034 155.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 160.6 -80.78 0.15 Allowed Glycine 0 C--N 1.341 0.861 0 CA-C-N 118.7 0.682 . . . . 20.0 112.175 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.6 ttmm -80.24 65.3 5.35 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 126.443 1.897 . . . . 20.0 110.922 -178.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 45.93 78.85 0.07 OUTLIER Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 128.464 2.935 . . . . 20.0 112.443 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -63.68 133.84 54.32 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.448 -0.876 . . . . 20.0 109.204 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.47 ' HE2' ' HB2' ' A' ' 54' ' ' CYS . 0.9 OUTLIER -142.39 130.64 22.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.115 0.966 . . . . 20.0 111.203 171.387 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.2 t -53.25 120.0 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.46 1.904 . . . . 20.0 111.722 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.9 t -158.97 85.86 0.82 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.743 0.817 . . . . 20.0 110.446 -172.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 1.7 t -129.56 10.67 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.406 1.082 . . . . 20.0 113.082 -174.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -84.52 178.64 7.63 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.688 1.595 . . . . 20.0 110.909 175.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 10.0 tt -84.91 -36.44 21.46 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.835 0.854 . . . . 20.0 110.987 176.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 . . . . . 0 C--O 1.249 1.059 0 C-N-CA 125.372 1.469 . . . . 20.0 109.714 -176.771 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 39.7 t-20 . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 109.527 -0.546 . . . . 20.0 109.527 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -62.66 -38.63 91.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.285 0.634 . . . . 20.0 112.098 -175.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.0 t -61.31 -47.05 87.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.349 1.46 . . . . 20.0 111.871 -179.289 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 88.8 t -77.58 -31.34 17.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.455 1.502 . . . . 20.0 111.411 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 46.2 m -63.7 -41.92 98.04 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.508 1.123 . . . . 20.0 111.738 173.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.55 -16.61 61.26 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.05 0.94 . . . . 20.0 112.879 174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.78 12.64 52.67 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 124.786 1.184 . . . . 20.0 114.306 172.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -83.73 178.52 7.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.365 1.466 . . . . 20.0 112.321 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -116.52 175.26 15.67 Favored Glycine 0 CA--C 1.531 1.034 0 C-N-CA 125.493 1.521 . . . . 20.0 112.449 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.6 m -123.27 52.56 1.38 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.297 1.439 . . . . 20.0 111.144 -175.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.65 153.04 88.47 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.008 0.923 . . . . 20.0 109.55 170.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -72.85 164.09 36.55 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 123.005 2.47 . . . . 20.0 111.63 175.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.4 mt-30 -62.42 -27.8 69.35 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.414 1.486 . . . . 20.0 111.229 172.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.6 m -64.66 -34.06 77.41 Favored 'General case' 0 C--N 1.344 0.352 0 C-N-CA 125.184 1.394 . . . . 20.0 112.473 174.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -87.37 -70.08 0.64 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.243 1.017 . . . . 20.0 110.518 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.6 m -69.94 144.22 92.8 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 124.168 0.987 . . . . 20.0 111.492 -177.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -71.04 170.64 17.59 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.045 3.164 . . . . 20.0 111.781 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -70.44 -23.49 62.73 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.584 1.154 . . . . 20.0 113.218 -170.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -81.77 -36.88 28.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 127.265 2.226 . . . . 20.0 112.459 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.86 -8.07 52.14 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.928 1.291 . . . . 20.0 113.486 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -72.15 101.69 2.85 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.115 1.366 . . . . 20.0 110.813 -178.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.93 169.96 10.65 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 126.123 1.769 . . . . 20.0 111.742 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.6 p -98.17 -11.67 22.54 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.339 1.456 . . . . 20.0 113.743 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -69.42 163.62 24.84 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.437 1.095 . . . . 20.0 112.032 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -114.55 174.49 15.49 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 125.207 1.384 . . . . 20.0 111.849 175.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.29 -3.97 20.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.045 1.307 . . . . 20.0 113.787 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 69.1 m -90.32 179.41 5.89 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.263 1.425 . . . . 20.0 112.363 175.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.4 p -97.46 -13.67 21.61 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.64 1.176 . . . . 20.0 112.042 173.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -142.94 -71.07 0.32 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.761 1.624 . . . . 20.0 110.33 -173.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -159.1 145.29 7.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 124.461 1.104 . . . . 20.0 109.927 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.0 m -77.35 131.83 38.28 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.503 1.121 . . . . 20.0 109.702 169.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.6 t -124.32 118.8 27.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.623 1.169 . . . . 20.0 109.592 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.83 86.18 0.5 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.713 1.205 . . . . 20.0 112.536 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.7 mt -63.72 -30.97 72.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.517 1.127 . . . . 20.0 112.68 -178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.1 t -64.11 -34.77 78.81 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 123.919 0.888 . . . . 20.0 111.55 177.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -101.57 -1.12 33.63 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 124.304 1.042 . . . . 20.0 112.759 -174.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.8 tp -79.84 -46.59 16.6 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.85 2.06 . . . . 20.0 110.43 176.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.1 t -78.48 172.68 13.3 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.78 1.632 . . . . 20.0 112.185 177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -141.75 -118.39 1.41 Allowed Glycine 0 CA--C 1.532 1.112 0 C-N-CA 125.796 1.665 . . . . 20.0 110.679 178.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.7 m -61.98 -21.98 65.29 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.298 1.439 . . . . 20.0 113.618 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -55.98 -25.07 42.34 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 113.539 0.94 . . . . 20.0 113.539 169.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.97 82.39 0.32 Allowed Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.887 1.708 . . . . 20.0 110.386 175.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -77.79 -77.37 0.16 Allowed 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.211 1.404 . . . . 20.0 107.921 173.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 67.49 4.0 29.05 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 124.406 1.003 . . . . 20.0 113.012 -166.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -90.7 -125.14 3.05 Favored Glycine 0 C--N 1.343 0.942 0 C-N-CA 125.038 1.304 . . . . 20.0 111.513 -174.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.82 167.02 23.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.478 1.111 . . . . 20.0 112.653 -171.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 32.7 t -112.1 82.09 1.57 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.317 1.447 . . . . 20.0 109.937 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -86.6 164.64 36.63 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 126.04 1.736 . . . . 20.0 111.104 176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -67.94 167.98 20.07 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.587 2.858 . . . . 20.0 112.921 -175.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.3 mt -64.63 -19.82 65.92 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.315 1.046 . . . . 20.0 112.65 172.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.29 -27.02 69.05 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.855 1.662 . . . . 20.0 111.926 175.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -70.46 127.84 34.11 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 125.021 1.328 . . . . 20.0 109.731 -177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -75.29 101.13 4.59 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.415 0.686 . . . . 20.0 110.247 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 p -160.97 -179.98 7.98 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.698 1.599 . . . . 20.0 111.194 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -59.38 165.54 2.72 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.715 2.006 . . . . 20.0 111.648 -177.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -139.44 128.55 23.81 Favored 'General case' 0 N--CA 1.46 0.07 0 C-N-CA 125.855 1.662 . . . . 20.0 109.63 179.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.6 mt -150.79 115.29 5.16 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 126.422 1.889 . . . . 20.0 109.769 176.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -64.9 -18.93 65.63 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 113.529 0.936 . . . . 20.0 113.529 175.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -75.02 -17.21 60.55 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.964 1.305 . . . . 20.0 114.032 179.27 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -129.54 -49.99 1.16 Allowed 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.707 1.203 . . . . 20.0 112.593 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.5 p -63.73 -18.59 64.19 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.025 1.12 . . . . 20.0 114.025 -178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.62 -13.5 42.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.467 1.507 . . . . 20.0 113.54 173.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 t -63.28 -46.03 88.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.522 1.129 . . . . 20.0 111.451 172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -12.2 57.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.415 0.686 . . . . 20.0 112.539 169.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 86.61 -162.33 34.43 Favored Glycine 0 CA--C 1.532 1.126 0 C-N-CA 124.766 1.174 . . . . 20.0 112.664 178.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -74.83 46.46 0.29 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.511 1.924 . . . . 20.0 113.445 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.6 7.94 1.55 Allowed Glycine 0 CA--C 1.532 1.152 0 C-N-CA 126.48 1.991 . . . . 20.0 112.528 173.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -144.86 161.74 38.56 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.848 1.259 . . . . 20.0 110.642 176.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -145.05 149.1 34.49 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.391 2.676 . . . . 20.0 108.444 173.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.6 t -52.64 109.0 0.35 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.854 0.862 . . . . 20.0 111.268 -173.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -118.36 18.29 13.68 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.154 0.982 . . . . 20.0 113.228 -167.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 t -138.64 116.76 12.73 Favored 'Isoleucine or valine' 0 C--N 1.343 0.3 0 C-N-CA 125.356 1.463 . . . . 20.0 107.995 -170.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 9.7 m0 -95.69 175.16 6.64 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.367 1.067 . . . . 20.0 110.858 175.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.45 -60.65 2.28 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.671 0.788 . . . . 20.0 110.46 -171.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 84.9 t60 . . . . . 0 C--O 1.25 1.121 0 C-N-CA 125.836 1.654 . . . . 20.0 111.719 -178.858 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.881 0.372 . . . . 20.0 110.161 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -63.88 -37.62 88.05 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.629 1.572 . . . . 20.0 111.657 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 91.2 m -58.4 -54.78 43.11 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.324 1.45 . . . . 20.0 111.279 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 50.9 t -67.52 -34.4 68.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 125.119 1.368 . . . . 20.0 111.066 -177.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 31.9 t -62.42 -41.48 98.72 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.101 1.361 . . . . 20.0 111.589 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -76.04 -14.02 60.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.609 1.164 . . . . 20.0 113.03 175.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 101.51 -2.03 53.41 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 125.781 1.658 . . . . 20.0 113.867 176.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -76.66 176.98 7.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.383 1.473 . . . . 20.0 111.714 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.79 176.45 18.16 Favored Glycine 0 CA--C 1.53 1.022 0 C-N-CA 124.886 1.232 . . . . 20.0 111.986 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -124.82 76.39 1.51 Allowed 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.775 1.23 . . . . 20.0 108.702 172.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -77.53 156.1 81.0 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.339 1.056 . . . . 20.0 109.534 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -68.94 160.13 51.09 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.5 2.134 . . . . 20.0 111.34 176.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -64.75 -20.85 66.59 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.986 0.914 . . . . 20.0 112.715 -178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.0 t -68.11 -55.72 11.45 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.017 0.927 . . . . 20.0 110.896 172.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.03 -54.97 9.3 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.45 1.1 . . . . 20.0 111.775 -177.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.5 t -62.35 115.86 19.02 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.363 1.065 . . . . 20.0 110.889 -177.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -69.04 156.45 65.18 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.785 2.323 . . . . 20.0 110.592 176.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -72.84 -17.0 61.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.819 0.848 . . . . 20.0 112.977 -166.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.403 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 4.7 pt-20 -72.61 -40.91 66.13 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 128.288 2.635 . . . . 20.0 111.97 173.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.37 -10.68 59.75 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.036 1.334 . . . . 20.0 112.937 -175.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -66.46 119.5 11.74 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.202 1.001 . . . . 20.0 110.78 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.7 mt -90.54 172.82 8.43 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.025 1.33 . . . . 20.0 110.715 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 t -87.54 -14.79 39.28 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.809 1.244 . . . . 20.0 112.204 177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -63.64 165.34 8.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.408 1.483 . . . . 20.0 112.538 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.83 -168.77 11.9 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 125.177 1.37 . . . . 20.0 113.343 -171.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 91.2 -11.11 73.12 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 126.224 1.869 . . . . 20.0 113.421 -173.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 77.2 m -67.17 172.23 4.89 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.62 1.168 . . . . 20.0 111.748 174.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.2 p -106.33 -5.77 18.84 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.097 1.759 . . . . 20.0 113.533 173.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.4 p -139.36 -72.64 0.39 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.266 1.827 . . . . 20.0 109.993 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.7 p -164.11 155.32 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.982 1.713 . . . . 20.0 109.002 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 1.4 t -76.02 160.02 30.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.883 0.873 . . . . 20.0 110.403 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.95 117.97 5.9 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 122.952 0.501 . . . . 20.0 110.825 176.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -71.74 93.74 1.31 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.805 1.242 . . . . 20.0 110.377 178.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 46.4 mt -68.95 -22.28 64.13 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.452 1.101 . . . . 20.0 112.888 -177.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.0 t -74.14 -15.52 61.03 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.746 1.218 . . . . 20.0 113.023 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -129.25 9.0 5.6 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.767 1.627 . . . . 20.0 113.243 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.8 tt -76.5 -54.12 7.15 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.772 1.229 . . . . 20.0 109.645 173.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 81.3 p -104.67 175.65 5.42 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 126.138 1.775 . . . . 20.0 111.599 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -160.54 -127.02 0.86 Allowed Glycine 0 C--N 1.343 0.96 0 C-N-CA 124.76 1.172 . . . . 20.0 111.123 -175.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 48.6 t -70.83 -67.5 0.5 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.144 0.978 . . . . 20.0 111.16 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -133.34 -49.58 0.85 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.817 1.247 . . . . 20.0 112.593 -162.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -158.28 -61.56 0.01 OUTLIER Glycine 0 C--N 1.344 1.005 0 C-N-CA 124.219 0.914 . . . . 20.0 113.0 -179.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.0 mmmt -68.21 -44.82 74.94 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.378 1.471 . . . . 20.0 111.819 178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 151.23 -25.25 0.99 Allowed Glycine 0 CA--C 1.532 1.122 0 C-N-CA 125.456 1.503 . . . . 20.0 112.881 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 98.86 156.57 29.24 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.637 1.589 . . . . 20.0 111.192 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.0 tp10 -137.42 136.02 37.45 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 125.159 1.383 . . . . 20.0 109.34 -179.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 73.8 m -82.56 94.89 7.6 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.405 0.682 . . . . 20.0 109.518 174.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -121.63 154.7 60.12 Favored Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 125.809 1.643 . . . . 20.0 110.858 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -68.39 156.48 65.49 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 123.676 2.917 . . . . 20.0 112.362 -170.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 89.4 mt -66.91 -19.84 65.8 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.595 0.758 . . . . 20.0 112.665 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -69.04 -27.02 65.27 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.929 1.692 . . . . 20.0 112.577 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -76.38 134.32 39.68 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 123.335 0.654 . . . . 20.0 109.993 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -68.15 99.22 0.87 Allowed 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.631 1.172 . . . . 20.0 110.157 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.33 173.43 8.88 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.866 1.266 . . . . 20.0 111.472 -177.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -68.25 166.95 15.32 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.534 1.133 . . . . 20.0 111.439 177.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -142.95 140.19 31.0 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 126.188 1.795 . . . . 20.0 109.447 -176.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.2 mt -146.48 87.75 1.74 Allowed 'General case' 0 C--O 1.239 0.527 0 C-N-CA 125.354 1.461 . . . . 20.0 111.337 -179.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -68.18 -9.57 47.79 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.749 1.018 . . . . 20.0 113.749 174.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -94.43 -7.62 40.97 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.547 1.539 . . . . 20.0 113.534 177.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -138.25 -56.78 0.65 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.922 1.289 . . . . 20.0 111.047 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 3.8 t -66.27 -20.55 66.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.221 1.408 . . . . 20.0 113.184 -176.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.63 -6.65 1.21 Allowed 'General case' 0 C--N 1.344 0.365 0 C-N-CA 126.966 2.106 . . . . 20.0 114.963 -178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.1 t -54.58 -28.84 48.97 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.391 0.996 . . . . 20.0 113.362 172.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.426 ' HB2' ' HB2' ' A' ' 68' ' ' GLN . 1.3 m -71.4 -75.69 0.12 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.22 1.008 . . . . 20.0 109.142 165.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 145.13 -62.64 0.47 Allowed Glycine 0 C--N 1.347 1.144 0 C-N-CA 123.918 0.771 . . . . 20.0 112.463 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 144.12 50.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.982 1.313 . . . . 20.0 110.291 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 55.59 46.92 80.19 Favored Glycine 0 C--N 1.342 0.863 0 C-N-CA 125.037 1.303 . . . . 20.0 113.069 -178.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.426 ' HB2' ' HB2' ' A' ' 64' ' ' CYS . 5.1 pm0 -127.5 -0.11 6.23 Favored 'General case' 0 C--N 1.347 0.471 0 N-CA-C 118.837 2.902 . . . . 20.0 118.837 -165.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -41.15 127.3 2.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.113 2.165 . . . . 20.0 113.981 -168.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 44.4 t -60.49 111.93 1.78 Allowed 'General case' 0 C--N 1.345 0.388 0 C-N-CA 123.904 0.881 . . . . 20.0 109.751 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.6 t -130.17 83.43 2.13 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.957 1.303 . . . . 20.0 108.332 -174.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.9 t -116.23 131.3 69.15 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 C-N-CA 126.016 1.727 . . . . 20.0 108.276 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 2.0 m0 -94.47 174.89 6.9 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.924 1.29 . . . . 20.0 110.637 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.514 ' H ' HD23 ' A' ' 74' ' ' LEU . 2.5 pt? -78.51 177.39 8.58 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.721 -0.672 . . . . 20.0 111.927 172.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.5 t60 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 117.4 -1.286 . . . . 20.0 111.54 178.293 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 45.3 p-10 . . . . . 0 N--CA 1.476 0.846 0 CA-C-O 121.2 0.524 . . . . 20.0 111.015 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.1 tp10 -59.67 -35.98 75.54 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.02 1.328 . . . . 20.0 112.964 -175.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.7 t -63.4 -35.99 82.23 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.473 1.109 . . . . 20.0 111.895 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.4 t -76.74 -41.95 33.58 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 C-N-CA 125.376 1.47 . . . . 20.0 110.634 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 72.6 m -62.17 -38.65 89.87 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.88 1.272 . . . . 20.0 112.743 -177.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -71.67 -15.94 62.24 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.736 1.214 . . . . 20.0 113.085 175.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 99.67 -1.07 56.77 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 125.211 1.386 . . . . 20.0 114.535 175.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -74.59 176.71 6.64 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.465 1.132 . . . . 20.0 111.333 175.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.24 178.65 19.18 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.049 1.309 . . . . 20.0 112.57 -176.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -131.63 68.31 1.5 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.383 1.473 . . . . 20.0 109.67 176.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.54 155.75 87.88 Favored Pre-proline 0 CA--C 1.541 0.614 0 N-CA-C 109.238 -0.653 . . . . 20.0 109.238 168.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.79 166.7 28.7 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.7 2.267 . . . . 20.0 111.018 174.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -63.64 -22.49 66.93 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 123.602 0.761 . . . . 20.0 111.753 174.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.7 m -74.04 -16.39 61.05 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.434 1.494 . . . . 20.0 113.899 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -126.1 -37.92 2.21 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.894 1.278 . . . . 20.0 112.597 -174.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 36.0 t -71.22 125.89 91.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 123.861 0.864 . . . . 20.0 110.039 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -69.12 153.53 71.74 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.688 2.258 . . . . 20.0 109.752 172.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -73.44 -14.4 61.24 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.361 1.065 . . . . 20.0 112.955 -167.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.434 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.7 pt-20 -76.56 -42.08 44.17 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.693 2.397 . . . . 20.0 112.226 174.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.9 -11.5 59.82 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.808 1.243 . . . . 20.0 113.577 -177.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -67.34 108.07 2.63 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.301 1.04 . . . . 20.0 111.127 -177.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.6 mt -76.07 172.39 12.86 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.883 1.273 . . . . 20.0 112.334 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 55.9 m -90.51 -11.22 40.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.192 1.397 . . . . 20.0 112.953 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 35.4 m-85 -71.71 175.06 6.0 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.799 1.24 . . . . 20.0 112.96 -176.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -130.21 177.52 18.17 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 125.524 1.535 . . . . 20.0 112.681 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.34 -11.06 26.36 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.972 1.749 . . . . 20.0 113.373 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 76.2 m -74.67 178.36 5.47 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.395 1.478 . . . . 20.0 112.263 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 70.4 m -115.55 -5.17 12.21 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.164 1.386 . . . . 20.0 112.322 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 18.1 p -138.75 -74.63 0.38 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.683 1.993 . . . . 20.0 109.204 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.4 p -161.1 158.83 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 C-N-CA 126.636 1.974 . . . . 20.0 108.271 179.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 31.8 m -75.18 163.07 27.92 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.808 0.843 . . . . 20.0 111.358 171.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.87 118.66 5.77 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.194 0.997 . . . . 20.0 110.084 170.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -69.3 100.45 1.34 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.811 1.245 . . . . 20.0 109.547 175.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 57.6 mt -67.95 -24.95 65.23 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.318 1.047 . . . . 20.0 112.267 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.8 t -74.93 -5.7 45.21 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.153 1.381 . . . . 20.0 112.499 175.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -121.22 10.04 10.56 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.934 1.694 . . . . 20.0 111.981 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 tp -106.76 -37.67 6.33 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.974 1.71 . . . . 20.0 111.043 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 65.0 p -122.48 150.14 42.92 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.547 1.939 . . . . 20.0 110.887 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.68 172.58 32.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 124.866 1.222 . . . . 20.0 113.001 -178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 98.1 m -81.17 -42.07 21.41 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.8 1.24 . . . . 20.0 111.933 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.6 tptm -137.4 -31.03 0.82 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.66 1.584 . . . . 20.0 112.139 174.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 101.8 67.85 0.8 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 124.936 1.255 . . . . 20.0 110.703 -176.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -131.38 -65.87 0.75 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.942 2.097 . . . . 20.0 108.72 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.56 -49.03 0.02 OUTLIER Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.838 1.209 . . . . 20.0 111.705 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.39 101.11 0.69 Allowed Glycine 0 C--N 1.342 0.89 0 C-N-CA 124.454 1.026 . . . . 20.0 111.271 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -69.18 150.31 47.64 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.872 0.869 . . . . 20.0 111.472 -176.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 15.4 t -110.87 28.66 8.49 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 125.821 1.648 . . . . 20.0 111.711 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -45.14 149.8 0.86 Allowed Pre-proline 0 CA--C 1.55 0.944 0 C-N-CA 127.809 2.444 . . . . 20.0 113.821 159.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.88 159.45 41.73 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 124.12 3.213 . . . . 20.0 112.84 -171.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.33 -18.78 64.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.332 1.053 . . . . 20.0 113.759 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -69.09 -29.8 67.97 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.994 1.318 . . . . 20.0 112.624 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -73.06 138.91 46.18 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.571 0.748 . . . . 20.0 110.664 -175.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -71.73 104.27 3.34 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.204 1.401 . . . . 20.0 111.329 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -163.5 177.99 8.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.034 1.734 . . . . 20.0 110.077 173.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -69.0 162.49 26.71 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.653 1.181 . . . . 20.0 110.814 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -148.32 134.76 19.62 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.785 1.234 . . . . 20.0 109.978 178.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.8 mt -146.18 110.91 5.19 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 126.594 1.958 . . . . 20.0 108.729 -177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 -62.95 -21.67 66.24 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.114 0.783 . . . . 20.0 113.114 -176.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.05 -35.74 74.5 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.429 1.092 . . . . 20.0 112.185 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -108.24 -31.19 7.99 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.881 1.273 . . . . 20.0 111.89 -170.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.8 p -84.1 -4.8 59.03 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.283 1.433 . . . . 20.0 113.828 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.3 -9.1 37.59 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.454 1.102 . . . . 20.0 113.012 174.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.7 t -60.86 -56.34 22.28 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.529 1.532 . . . . 20.0 112.258 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -79.31 -12.45 59.93 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 118.805 0.73 . . . . 20.0 112.184 172.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.19 -164.81 44.43 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.741 1.162 . . . . 20.0 112.588 -177.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -54.76 107.56 0.3 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.096 1.758 . . . . 20.0 111.635 177.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 134.18 -17.7 4.29 Favored Glycine 0 CA--C 1.535 1.318 0 C-N-CA 125.288 1.423 . . . . 20.0 112.824 -177.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 tm0? -110.59 147.99 33.09 Favored 'General case' 0 C--N 1.343 0.299 0 CA-C-N 118.967 1.383 . . . . 20.0 111.017 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -132.17 153.81 50.18 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.141 1.777 . . . . 20.0 109.706 175.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 41.2 t -66.89 96.77 0.44 Allowed 'General case' 0 C--N 1.346 0.443 0 C-N-CA 124.581 1.152 . . . . 20.0 110.92 -176.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 10.8 t -143.39 111.49 6.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.073 1.349 . . . . 20.0 109.811 -176.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.2 p -148.12 157.97 8.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 124.049 0.94 . . . . 20.0 110.302 177.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -130.88 178.81 6.38 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.429 1.492 . . . . 20.0 109.965 174.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mp -102.02 -14.55 17.1 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.393 1.077 . . . . 20.0 111.671 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 67.7 m80 . . . . . 0 C--O 1.25 1.104 0 C-N-CA 126.715 2.006 . . . . 20.0 109.255 178.906 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 . . . . . 0 N--CA 1.474 0.737 0 CA-C-O 120.884 0.373 . . . . 20.0 110.518 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -122.27 -38.58 2.67 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.646 1.978 . . . . 20.0 110.476 -175.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.4 m -68.64 -27.57 66.12 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.98 1.712 . . . . 20.0 112.774 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 79.5 t -63.2 -53.3 47.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.175 1.39 . . . . 20.0 109.981 169.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 22.8 t -61.77 -33.53 74.25 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.237 1.015 . . . . 20.0 112.274 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -72.91 -56.77 4.7 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.566 1.146 . . . . 20.0 110.561 173.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 115.22 53.07 0.4 Allowed Glycine 0 CA--C 1.533 1.157 0 C-N-CA 125.497 1.522 . . . . 20.0 112.978 175.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.1 m-85 -116.98 179.71 3.94 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.671 1.589 . . . . 20.0 111.396 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.28 168.4 19.89 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.218 0.914 . . . . 20.0 112.697 -175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.8 m -120.58 83.93 2.14 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.235 1.414 . . . . 20.0 108.897 174.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -98.78 155.65 36.45 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 124.669 1.188 . . . . 20.0 108.468 171.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -71.86 162.15 42.83 Favored 'Trans proline' 0 N--CA 1.456 -0.718 0 C-N-CA 122.652 2.235 . . . . 20.0 111.184 173.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -62.23 -28.42 69.68 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.7 1.2 . . . . 20.0 111.329 173.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.0 p -73.2 -16.14 61.43 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.719 1.208 . . . . 20.0 113.818 175.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -97.39 -66.27 0.91 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 124.415 1.086 . . . . 20.0 110.34 175.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.6 m -72.0 143.18 86.11 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 123.876 0.87 . . . . 20.0 111.234 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -72.21 173.38 13.09 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 124.384 3.389 . . . . 20.0 111.178 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -74.04 7.77 2.47 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.564 1.546 . . . . 20.0 113.841 -172.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -123.54 -38.13 2.57 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.624 1.97 . . . . 20.0 112.699 -172.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.59 -15.4 63.41 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.339 1.056 . . . . 20.0 113.304 172.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -67.77 109.86 3.54 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 126.118 1.767 . . . . 20.0 110.421 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.1 mt -74.35 169.58 17.37 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.393 1.477 . . . . 20.0 111.683 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -103.22 -6.64 21.9 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.103 1.361 . . . . 20.0 112.813 -179.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -64.44 176.07 1.19 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.881 1.672 . . . . 20.0 111.215 167.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -141.34 174.49 22.85 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 123.865 0.745 . . . . 20.0 113.6 178.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.03 -4.42 20.5 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 126.182 1.849 . . . . 20.0 114.384 175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 50.3 m -73.22 -177.52 2.56 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.68 1.24 . . . . 20.0 111.471 165.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.1 m -99.52 -10.69 21.82 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.813 0.845 . . . . 20.0 111.899 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 16.4 p -138.95 -70.68 0.41 Allowed 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.955 1.702 . . . . 20.0 109.513 178.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -157.47 144.37 9.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.117 1.367 . . . . 20.0 109.186 -178.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 68.2 m -81.45 132.92 35.34 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.482 0.713 . . . . 20.0 109.619 173.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.8 t -126.19 114.93 18.98 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.961 1.304 . . . . 20.0 109.613 -174.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -67.38 99.83 0.77 Allowed 'General case' 0 C--N 1.345 0.407 0 C-N-CA 124.788 1.235 . . . . 20.0 110.106 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 67.4 mt -68.73 -27.89 66.33 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.303 1.041 . . . . 20.0 112.149 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.6 m -72.98 -10.12 59.46 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.053 1.341 . . . . 20.0 112.957 173.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.4 mttt -121.58 21.88 10.77 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.613 1.565 . . . . 20.0 111.175 174.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.82 -59.46 1.96 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.313 1.845 . . . . 20.0 108.295 176.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 76.5 p -90.95 156.51 17.92 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.085 1.354 . . . . 20.0 111.165 178.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 142.05 -176.73 21.92 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 125.4 1.476 . . . . 20.0 111.581 -175.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 1.2 m -59.61 -25.6 64.76 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.044 0.937 . . . . 20.0 112.76 171.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -61.05 -12.26 11.25 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.776 1.63 . . . . 20.0 114.0 169.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -70.26 -87.5 0.11 Allowed Glycine 0 C--N 1.342 0.907 0 C-N-CA 125.604 1.574 . . . . 20.0 111.148 178.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.5 -53.59 5.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.175 0.99 . . . . 20.0 110.173 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 161.63 -15.79 0.16 Allowed Glycine 0 CA--C 1.534 1.277 0 CA-C-O 118.63 -1.094 . . . . 20.0 114.468 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.98 176.4 37.98 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 118.618 1.209 . . . . 20.0 113.449 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -145.59 157.64 43.95 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.61 1.164 . . . . 20.0 110.924 177.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.5 t -86.62 22.5 1.89 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 127.422 2.289 . . . . 20.0 112.127 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -58.93 148.91 68.12 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.893 1.277 . . . . 20.0 111.049 177.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -69.75 166.09 28.75 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 124.242 3.295 . . . . 20.0 113.469 -166.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -60.72 -23.85 65.23 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.378 1.071 . . . . 20.0 112.605 173.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -71.92 -13.03 61.53 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.261 1.424 . . . . 20.0 113.085 177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.3 tpt85 -78.71 153.52 30.82 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.518 1.127 . . . . 20.0 110.269 177.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -102.68 101.63 11.76 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.533 1.133 . . . . 20.0 109.443 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.2 p -169.63 161.44 9.43 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 126.176 1.79 . . . . 20.0 111.077 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -80.88 110.14 16.12 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.087 1.755 . . . . 20.0 111.447 -173.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -79.6 151.41 30.63 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.46 0.704 . . . . 20.0 110.573 168.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.79 16.48 2.5 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.895 1.678 . . . . 20.0 114.54 175.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.2 pt20 51.85 21.37 1.42 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 130.251 3.42 . . . . 20.0 116.989 169.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -129.3 -71.89 0.61 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.271 1.429 . . . . 20.0 110.402 -167.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -63.47 -36.69 84.6 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 20.0 111.23 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.2 t -69.12 -32.03 71.15 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.18 1.792 . . . . 20.0 113.441 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.35 -7.06 16.6 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.009 1.324 . . . . 20.0 114.341 -171.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 49.8 m -59.65 -42.6 93.16 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.227 1.411 . . . . 20.0 111.844 171.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 19.4 m -79.13 -11.47 59.98 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.839 1.256 . . . . 20.0 113.331 173.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 88.57 -98.83 2.47 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 125.319 1.438 . . . . 20.0 111.467 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -132.08 161.5 33.1 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.749 1.619 . . . . 20.0 110.588 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 93.63 -8.3 74.31 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 124.965 1.269 . . . . 20.0 113.598 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -123.75 178.61 5.15 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.849 1.66 . . . . 20.0 112.255 178.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -146.18 162.89 37.02 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 126.134 1.774 . . . . 20.0 110.537 167.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.65 123.27 17.45 Favored 'General case' 0 C--N 1.348 0.502 0 N-CA-C 107.738 -1.208 . . . . 20.0 107.738 167.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.1 t -140.03 105.83 5.16 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 123.272 0.629 . . . . 20.0 109.875 -177.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.3 p -145.36 146.96 19.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.981 1.312 . . . . 20.0 109.345 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.1 m0 -112.39 177.21 4.72 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.263 1.425 . . . . 20.0 110.857 -175.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.2 tp -82.01 -169.82 2.57 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.462 1.105 . . . . 20.0 110.543 176.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.161 0 C-N-CA 126.079 1.751 . . . . 20.0 113.854 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 20.1 p30 . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.772 0.32 . . . . 20.0 111.344 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -121.6 -42.99 2.4 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.861 1.264 . . . . 20.0 111.487 -177.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' SG ' ' HB2' ' A' ' 24' ' ' TYR . 61.2 m -61.92 -34.89 76.89 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.477 0.711 . . . . 20.0 111.392 176.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 85.4 t -61.29 -49.55 84.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.282 1.433 . . . . 20.0 110.367 172.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.2 t -63.89 -33.41 75.63 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.98 1.312 . . . . 20.0 112.455 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mmtm -82.4 -8.25 59.63 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.52 1.528 . . . . 20.0 113.104 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 96.29 15.32 41.69 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.558 1.075 . . . . 20.0 114.512 173.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -100.34 -177.57 3.55 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.052 1.741 . . . . 20.0 111.695 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -123.3 170.08 15.62 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 125.28 1.419 . . . . 20.0 112.525 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.6 m -113.62 78.84 1.18 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.006 1.322 . . . . 20.0 109.834 179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.13 156.78 74.07 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 123.972 0.909 . . . . 20.0 109.491 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.05 161.65 45.19 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.771 2.314 . . . . 20.0 110.694 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -64.06 -29.92 71.02 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.898 0.879 . . . . 20.0 111.17 176.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 t -62.66 -36.15 81.94 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.613 1.165 . . . . 20.0 112.542 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -86.89 -58.09 2.73 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.943 0.897 . . . . 20.0 111.047 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 34.9 t -67.42 118.48 57.1 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.955 1.302 . . . . 20.0 110.978 -176.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -71.46 162.25 42.9 Favored 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 123.321 2.681 . . . . 20.0 110.845 176.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -73.52 -14.69 61.26 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.427 1.091 . . . . 20.0 113.461 -166.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -73.38 -34.04 65.34 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 128.226 2.61 . . . . 20.0 112.244 175.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -96.12 -6.43 38.44 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.197 1.799 . . . . 20.0 114.104 -173.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -71.52 105.53 3.64 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.079 0.951 . . . . 20.0 110.434 177.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.36 169.44 12.31 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.436 1.494 . . . . 20.0 111.808 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.3 t -93.8 -15.04 25.51 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.781 1.233 . . . . 20.0 112.677 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 22.9 m-85 -63.57 170.61 3.08 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.703 1.601 . . . . 20.0 111.491 170.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -147.25 -178.65 22.69 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.134 0.874 . . . . 20.0 113.587 -176.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 119.66 -13.18 10.85 Favored Glycine 0 CA--C 1.536 1.403 0 C-N-CA 126.627 2.061 . . . . 20.0 113.65 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 87.8 m -69.32 176.29 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.57 1.548 . . . . 20.0 112.909 179.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.3 t -90.64 -15.68 30.02 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.65 0.78 . . . . 20.0 111.077 176.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.4 p -137.69 -74.78 0.41 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.987 1.715 . . . . 20.0 109.65 -176.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -161.98 161.06 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.236 1.814 . . . . 20.0 108.525 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.8 m -92.29 162.55 14.24 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.435 0.694 . . . . 20.0 110.965 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -146.85 121.15 9.58 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.013 0.925 . . . . 20.0 109.378 177.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -70.79 92.74 0.91 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.944 0.897 . . . . 20.0 111.563 178.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -64.11 -30.26 71.33 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.842 1.257 . . . . 20.0 112.485 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.7 p -71.23 -7.72 48.74 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.943 1.697 . . . . 20.0 113.507 177.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -123.54 1.52 8.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.387 1.475 . . . . 20.0 112.862 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.03 -56.3 2.53 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.205 1.802 . . . . 20.0 109.357 177.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 48.1 p -61.27 167.11 3.35 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.873 2.069 . . . . 20.0 113.743 -175.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 169.75 -102.37 0.18 Allowed Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.771 1.653 . . . . 20.0 109.782 175.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 57.2 m -74.04 -41.53 61.64 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.045 0.938 . . . . 20.0 113.065 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.2 ttmp? -142.9 -73.65 0.29 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.474 1.109 . . . . 20.0 110.614 -175.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -136.6 -67.48 0.06 OUTLIER Glycine 0 C--N 1.34 0.791 0 C-N-CA 125.18 1.371 . . . . 20.0 110.818 -174.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -71.17 -13.99 62.12 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.535 1.534 . . . . 20.0 113.852 174.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.1 -22.37 36.9 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.612 1.577 . . . . 20.0 114.012 174.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.67 173.97 43.73 Favored Glycine 0 CA--C 1.534 1.255 0 C-N-CA 125.677 1.608 . . . . 20.0 114.183 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -138.16 169.06 18.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.144 1.378 . . . . 20.0 112.99 -173.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 12.0 t -95.8 33.91 1.6 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 127.032 2.133 . . . . 20.0 112.164 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.44 156.11 44.05 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.633 1.573 . . . . 20.0 112.895 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.46 159.42 44.4 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.711 3.607 . . . . 20.0 112.08 -171.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.2 -21.14 64.88 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.019 1.328 . . . . 20.0 112.518 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.29 -25.33 66.8 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.743 1.617 . . . . 20.0 112.836 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.55 150.97 42.7 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.817 1.247 . . . . 20.0 110.536 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 61.8 mt-30 -134.02 102.47 5.43 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.906 1.282 . . . . 20.0 109.188 -179.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.39 -87.73 0.08 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.444 1.897 . . . . 20.0 107.739 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -146.57 165.82 28.35 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.203 1.801 . . . . 20.0 109.302 172.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -140.96 163.53 32.72 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.977 0.911 . . . . 20.0 111.238 170.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 6.2 tp -169.23 109.92 0.47 Allowed 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 107.498 -1.297 . . . . 20.0 107.498 -175.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -67.1 -18.93 65.54 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.305 1.442 . . . . 20.0 114.147 -172.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -59.7 -27.7 66.67 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.005 1.113 . . . . 20.0 114.005 -177.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mt-10 -127.5 -30.56 2.57 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.767 1.227 . . . . 20.0 111.832 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 54.7 p -70.46 -22.65 62.66 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.894 1.072 . . . . 20.0 113.894 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.28 -6.38 6.79 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.617 1.567 . . . . 20.0 114.412 -177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 68.1 m -126.45 67.81 1.23 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.552 1.541 . . . . 20.0 109.401 167.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 1.2 m -130.86 -27.72 2.06 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.002 1.321 . . . . 20.0 113.934 171.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 67.62 -92.15 0.23 Allowed Glycine 0 CA--C 1.53 0.993 0 C-N-CA 124.836 1.207 . . . . 20.0 111.923 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -77.13 41.33 0.29 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.97 2.108 . . . . 20.0 112.828 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 160.72 60.07 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 C-N-CA 123.75 0.69 . . . . 20.0 113.429 175.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -86.03 79.76 9.07 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 123.069 1.414 . . . . 20.0 111.314 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -167.66 119.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 128.395 2.678 . . . . 20.0 110.031 166.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -72.72 88.37 1.29 Allowed 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.056 0.455 . . . . 20.0 110.807 176.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 26.4 t -81.53 132.77 35.32 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.459 1.904 . . . . 20.0 110.263 -178.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.2 p -153.48 162.2 2.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 123.523 0.729 . . . . 20.0 110.379 174.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 7.5 m0 -129.03 178.31 6.49 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.969 1.707 . . . . 20.0 111.066 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.95 -175.71 1.52 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.206 1.402 . . . . 20.0 111.946 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.8 p80 . . . . . 0 C--O 1.251 1.162 0 C-N-CA 126.124 1.769 . . . . 20.0 113.849 -176.443 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.3 p30 . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 111.468 0.173 . . . . 20.0 111.468 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -121.96 -51.37 2.02 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 124.624 1.169 . . . . 20.0 110.3 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.7 m -62.74 -36.47 83.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.708 1.203 . . . . 20.0 111.523 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.14 -43.49 95.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.508 1.523 . . . . 20.0 110.013 174.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 19.6 t -62.6 -38.41 90.03 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.082 0.953 . . . . 20.0 111.839 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -70.75 -30.07 66.48 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.484 1.114 . . . . 20.0 112.16 176.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.72 -2.23 23.17 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 125.771 1.653 . . . . 20.0 114.619 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -71.98 -179.15 2.63 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.349 1.86 . . . . 20.0 112.277 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.81 171.9 18.43 Favored Glycine 0 CA--C 1.53 1.026 0 C-N-CA 124.785 1.184 . . . . 20.0 113.195 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 63.4 m -113.2 82.35 1.65 Allowed 'General case' 0 C--O 1.233 0.204 0 C-N-CA 125.68 1.592 . . . . 20.0 109.837 -175.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -86.64 156.04 56.12 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.408 1.083 . . . . 20.0 109.253 173.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -72.31 164.69 34.88 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 122.741 2.294 . . . . 20.0 110.809 170.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -64.52 -25.61 68.06 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.757 1.223 . . . . 20.0 112.013 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 t -69.59 -36.39 76.2 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.287 1.035 . . . . 20.0 112.124 177.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -86.62 -52.84 5.3 Favored 'General case' 0 C--N 1.344 0.349 0 C-N-CA 124.151 0.98 . . . . 20.0 111.475 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 38.1 t -67.2 119.33 63.93 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 124.36 1.064 . . . . 20.0 110.497 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -69.45 158.42 57.43 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.807 2.338 . . . . 20.0 110.321 175.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -73.44 -16.34 61.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.357 1.063 . . . . 20.0 112.878 -165.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -76.55 -40.75 48.9 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.597 2.359 . . . . 20.0 111.772 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.23 -4.71 51.93 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.872 1.669 . . . . 20.0 113.833 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.94 107.9 5.57 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 124.275 1.03 . . . . 20.0 110.84 -179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.04 170.65 10.95 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.911 1.684 . . . . 20.0 112.196 178.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 t -99.78 -11.11 21.08 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.571 1.548 . . . . 20.0 112.55 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -65.24 174.61 1.98 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.226 1.811 . . . . 20.0 111.306 170.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -146.92 176.75 25.64 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 123.669 0.652 . . . . 20.0 113.406 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.07 -12.71 17.03 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 126.136 1.826 . . . . 20.0 113.862 177.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.9 m -69.01 175.86 3.49 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 118.725 1.262 . . . . 20.0 112.323 173.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.6 p -85.07 -22.85 28.8 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 124.529 1.132 . . . . 20.0 111.251 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.9 p -140.9 -67.71 0.41 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.086 1.354 . . . . 20.0 110.297 -170.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.8 p -160.7 147.47 5.55 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 125.179 1.392 . . . . 20.0 109.862 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 71.9 m -87.32 131.02 34.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.741 1.216 . . . . 20.0 110.129 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.6 t -124.6 127.55 47.54 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.517 1.127 . . . . 20.0 109.701 -174.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -76.75 80.95 3.36 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.903 0.881 . . . . 20.0 113.3 -175.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.1 mt -61.62 -26.82 68.23 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.531 1.532 . . . . 20.0 113.95 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.6 m -67.3 -18.68 65.28 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.347 1.059 . . . . 20.0 113.048 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -136.12 7.25 3.14 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.78 1.632 . . . . 20.0 113.545 -176.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 38.2 tp -67.82 -45.38 74.88 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.192 1.397 . . . . 20.0 110.65 172.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 33.6 p -113.61 -70.48 0.8 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.363 1.465 . . . . 20.0 111.271 -171.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -161.23 -164.66 16.53 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 123.951 0.786 . . . . 20.0 112.89 -172.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.0 m -47.5 -56.48 6.98 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.368 1.867 . . . . 20.0 111.339 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.4 tttt 58.99 15.6 4.08 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 127.002 2.121 . . . . 20.0 114.955 170.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.3 -65.88 2.58 Favored Glycine 0 CA--C 1.527 0.831 0 C-N-CA 125.561 1.553 . . . . 20.0 113.174 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -125.91 -24.89 3.7 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.839 1.256 . . . . 20.0 113.779 -174.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 137.61 20.3 0.55 Allowed Glycine 0 CA--C 1.53 0.998 0 CA-C-O 118.805 -0.997 . . . . 20.0 114.185 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.61 -161.19 3.68 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 125.536 1.541 . . . . 20.0 113.986 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -139.82 140.62 36.65 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.153 1.381 . . . . 20.0 110.593 -172.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -89.43 122.25 32.45 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.559 0.744 . . . . 20.0 109.956 165.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -137.45 154.97 75.68 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 126.81 2.044 . . . . 20.0 110.035 173.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -63.81 164.99 19.76 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.724 3.616 . . . . 20.0 114.409 -165.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.23 -15.04 30.53 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.163 1.385 . . . . 20.0 113.834 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.7 m-20 -88.91 -6.55 57.22 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.425 1.49 . . . . 20.0 113.922 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 30.3 tpt180 -67.28 -22.26 65.66 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.588 1.155 . . . . 20.0 114.107 -170.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 67.06 1.8 2.49 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.458 1.903 . . . . 20.0 114.525 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 48.5 t -63.58 -87.83 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.26 1.824 . . . . 20.0 112.207 -175.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttp -153.79 161.45 42.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.634 1.974 . . . . 20.0 109.121 175.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 tt0 -128.24 141.23 51.52 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 126.781 2.032 . . . . 20.0 109.684 176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 68.0 mt -139.7 105.22 5.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.518 1.927 . . . . 20.0 108.889 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -63.54 -20.85 65.96 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.822 1.192 . . . . 20.0 113.46 174.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.06 -15.96 60.02 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.814 1.246 . . . . 20.0 113.983 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -129.83 -44.88 1.18 Allowed 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.712 1.205 . . . . 20.0 112.138 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.7 m -66.47 -28.98 69.01 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 125.202 1.401 . . . . 20.0 113.228 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.11 -14.97 58.53 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.4 . . . . 20.0 112.992 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.4 m -68.44 -51.02 48.26 Favored 'General case' 0 C--N 1.344 0.368 0 C-N-CA 125.533 1.533 . . . . 20.0 111.616 173.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 23.3 m -69.1 -26.75 65.07 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.922 0.889 . . . . 20.0 111.517 169.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 112.24 -179.06 19.36 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 125.729 1.633 . . . . 20.0 113.278 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.33 45.3 0.37 Allowed 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 128.282 2.633 . . . . 20.0 113.194 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -143.49 -2.72 0.91 Allowed Glycine 0 CA--C 1.535 1.311 0 C-N-CA 126.972 2.225 . . . . 20.0 113.018 176.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -135.87 171.21 14.79 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.048 1.424 . . . . 20.0 111.297 176.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -144.34 120.44 10.77 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.308 2.243 . . . . 20.0 110.509 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.5 t -81.09 125.49 30.28 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.262 1.425 . . . . 20.0 112.027 -165.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 35.8 m -71.99 -12.58 61.3 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 115.006 1.484 . . . . 20.0 115.006 -179.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.0 p -71.52 171.75 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.454 1.101 . . . . 20.0 112.069 -173.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -123.02 178.74 4.93 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.912 1.685 . . . . 20.0 111.083 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 66.6 mt -126.65 159.33 33.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.923 1.689 . . . . 20.0 110.261 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . 0.263 44.6 p-80 . . . . . 0 C--O 1.254 1.305 0 C-N-CA 128.885 2.874 . . . . 20.0 114.168 -170.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.939 -0.393 . . . . 20.0 109.939 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.84 -39.66 93.93 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.849 0.86 . . . . 20.0 112.593 -173.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.4 t -63.79 -33.9 76.7 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.181 0.993 . . . . 20.0 111.754 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 59.5 t -76.53 -42.6 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 125.274 1.43 . . . . 20.0 110.843 175.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.2 t -59.52 -45.03 92.93 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.864 1.666 . . . . 20.0 111.889 -177.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -69.06 -13.06 62.22 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.808 1.243 . . . . 20.0 113.443 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 97.28 5.75 57.95 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 125.4 1.476 . . . . 20.0 114.036 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -81.01 177.29 9.15 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.271 1.028 . . . . 20.0 112.011 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.97 177.05 18.0 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.235 1.398 . . . . 20.0 112.222 -174.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.4 m -131.24 71.91 1.49 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.922 1.289 . . . . 20.0 110.27 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -74.87 159.21 83.52 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.832 1.253 . . . . 20.0 109.696 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -69.73 161.04 47.48 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.391 2.061 . . . . 20.0 110.65 172.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.61 -21.47 66.72 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.0 0.92 . . . . 20.0 111.779 176.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.4 m -71.01 -17.98 62.61 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.541 1.536 . . . . 20.0 114.167 175.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -117.76 -46.12 2.66 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 124.558 1.143 . . . . 20.0 111.319 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 23.4 t -66.61 119.03 59.93 Favored Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 123.53 0.732 . . . . 20.0 110.537 177.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -71.33 161.25 46.29 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.327 2.684 . . . . 20.0 110.477 175.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -76.12 -13.5 60.2 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.416 0.895 . . . . 20.0 113.416 -166.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.07 -42.76 62.72 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.701 2.4 . . . . 20.0 111.794 171.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.72 -9.46 59.43 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.231 1.413 . . . . 20.0 113.482 -175.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -71.68 102.77 2.87 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.805 1.242 . . . . 20.0 111.33 -177.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.6 mt -75.57 167.12 22.5 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.872 1.269 . . . . 20.0 112.166 -178.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -87.67 -12.14 46.3 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.673 1.589 . . . . 20.0 112.773 179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -69.89 170.39 11.26 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.744 1.217 . . . . 20.0 111.912 179.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -127.12 177.76 17.23 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 125.113 1.34 . . . . 20.0 112.669 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 113.03 -8.63 25.23 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.854 1.692 . . . . 20.0 113.53 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.0 m -77.52 175.83 9.47 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.555 1.142 . . . . 20.0 112.42 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -114.2 -5.06 13.02 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.317 1.447 . . . . 20.0 111.99 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 19.8 p -137.33 -71.83 0.43 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.998 1.719 . . . . 20.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -163.65 153.18 2.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.084 1.754 . . . . 20.0 109.42 177.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 m -70.94 157.32 38.38 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 123.853 0.861 . . . . 20.0 111.823 171.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -153.29 119.1 5.34 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.009 0.924 . . . . 20.0 110.185 174.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.9 p30 -71.76 90.51 1.09 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.017 0.927 . . . . 20.0 112.587 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 39.5 mt -60.93 -37.61 82.91 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.66 1.184 . . . . 20.0 112.681 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.2 p -73.84 -5.54 41.56 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.872 1.269 . . . . 20.0 113.774 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.4 mtmt -129.9 5.93 5.03 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.505 1.522 . . . . 20.0 113.116 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.7 tp -69.22 -49.14 59.18 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 126.083 1.753 . . . . 20.0 112.03 -170.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 28.46 81.9 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 129.302 3.041 . . . . 20.0 113.656 -175.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -161.69 164.58 35.27 Favored Glycine 0 CA--C 1.527 0.837 0 C-N-CA 125.246 1.403 . . . . 20.0 111.983 177.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.97 -42.15 70.11 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.795 0.838 . . . . 20.0 112.412 -170.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -67.51 -14.95 63.39 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.306 1.042 . . . . 20.0 113.16 174.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -61.4 -20.47 58.82 Favored Glycine 0 CA--C 1.538 1.471 0 C-N-CA 125.08 1.324 . . . . 20.0 114.2 175.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -124.32 -22.74 4.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.749 2.02 . . . . 20.0 111.518 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 81.13 68.54 1.46 Allowed Glycine 0 C--N 1.343 0.936 0 N-CA-C 109.788 -1.325 . . . . 20.0 109.788 -176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.88 165.26 48.64 Favored Glycine 0 CA--C 1.53 1.006 0 C-N-CA 124.142 0.877 . . . . 20.0 113.645 -174.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 0.6 OUTLIER -86.54 168.23 13.88 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.56 1.144 . . . . 20.0 111.541 -179.54 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 69.7 m -112.55 107.83 16.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.29 1.036 . . . . 20.0 110.27 175.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -129.09 159.14 70.39 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 126.953 2.101 . . . . 20.0 109.411 178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -69.48 170.86 15.26 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 123.088 2.525 . . . . 20.0 113.07 -171.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.2 mt -54.14 -35.9 62.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.727 1.211 . . . . 20.0 112.479 169.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -79.84 4.89 15.16 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.81 1.644 . . . . 20.0 113.665 -175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.6 tpp180 -64.3 -13.23 48.73 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.186 1.394 . . . . 20.0 113.573 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? 72.29 2.69 4.42 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.048 2.139 . . . . 20.0 112.976 176.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.1 165.92 3.96 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.313 1.845 . . . . 20.0 111.064 167.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -139.44 92.1 2.55 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 123.922 0.889 . . . . 20.0 110.682 -172.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -154.88 -173.49 4.59 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.39 1.476 . . . . 20.0 110.058 174.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -55.98 152.58 10.03 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.184 1.394 . . . . 20.0 113.02 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -131.64 2.46 4.11 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.641 1.176 . . . . 20.0 112.381 -171.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.09 -78.33 0.18 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.139 1.376 . . . . 20.0 110.916 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -68.77 -33.11 73.34 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.885 1.274 . . . . 20.0 112.437 -175.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 58.1 m -62.16 -31.16 71.62 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.116 1.366 . . . . 20.0 112.251 178.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.5 -9.74 37.64 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 114.866 1.432 . . . . 20.0 114.866 -172.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.9 t -58.34 -16.7 15.51 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.682 1.593 . . . . 20.0 114.181 177.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.74 -17.55 53.24 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 114.19 1.182 . . . . 20.0 114.19 -176.349 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 138.71 -81.02 0.27 Allowed Glycine 0 CA--C 1.533 1.161 0 C-N-CA 124.027 0.822 . . . . 20.0 112.755 171.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -79.48 59.82 3.05 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.051 1.74 . . . . 20.0 111.965 -173.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 48.93 23.95 4.0 Favored Glycine 0 C--N 1.346 1.111 0 C-N-CA 129.863 3.601 . . . . 20.0 114.931 -176.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -41.69 146.02 0.27 Allowed 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 128.213 2.605 . . . . 20.0 112.715 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -135.46 133.38 38.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.552 -1.204 . . . . 20.0 109.704 -177.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 34.6 t -51.45 131.93 29.34 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 124.314 1.009 . . . . 20.0 110.961 -178.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.9 t -138.9 20.93 2.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.993 1.317 . . . . 20.0 111.525 -171.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 95.3 t -60.53 140.44 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 125.044 1.338 . . . . 20.0 109.776 170.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 3.6 m0 -125.36 176.05 7.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.896 1.679 . . . . 20.0 110.245 175.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.1 mt -78.08 162.41 26.7 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.334 0.653 . . . . 20.0 110.794 174.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 C--O 1.251 1.148 0 CA-C-O 117.328 -1.32 . . . . 20.0 110.478 175.113 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 . . . . . 0 N--CA 1.474 0.754 0 CA-C-O 121.173 0.511 . . . . 20.0 110.844 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 25.9 tp10 -64.99 -41.34 95.5 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.15 0.98 . . . . 20.0 112.999 -170.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.7 m -58.05 -52.48 65.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.033 0.933 . . . . 20.0 110.902 176.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.9 t -65.38 -36.23 77.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 125.956 1.702 . . . . 20.0 111.414 -176.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 37.4 t -64.84 -35.97 82.83 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.674 1.189 . . . . 20.0 111.99 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -77.78 -18.13 56.76 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.543 0.737 . . . . 20.0 111.895 174.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 108.19 -7.67 35.21 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 126.598 2.047 . . . . 20.0 113.144 177.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -70.4 174.74 5.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.94 1.696 . . . . 20.0 112.279 178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -128.71 -176.5 14.46 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 124.996 1.284 . . . . 20.0 112.604 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.1 m -125.74 58.55 1.32 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.414 1.485 . . . . 20.0 110.758 -173.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.83 156.42 87.11 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 125.035 1.334 . . . . 20.0 110.015 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_endo -70.9 162.73 41.63 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.595 2.197 . . . . 20.0 110.875 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -65.6 -16.62 63.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.572 0.749 . . . . 20.0 111.962 173.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.9 m -72.84 -28.61 62.64 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.506 1.522 . . . . 20.0 113.067 173.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -107.59 -47.87 3.54 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 124.533 1.133 . . . . 20.0 111.24 -175.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 20.2 t -65.94 121.04 73.96 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 124.909 1.284 . . . . 20.0 109.776 172.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.81 170.18 18.45 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.54 2.827 . . . . 20.0 110.499 174.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -77.94 -10.73 59.73 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.658 0.985 . . . . 20.0 113.658 -171.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 19' ' ' GLU . 6.8 pt-20 -85.34 -37.46 19.89 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.89 2.076 . . . . 20.0 112.316 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.26 -2.85 43.12 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.35 1.86 . . . . 20.0 113.657 -176.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -75.94 97.97 4.12 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 124.571 1.148 . . . . 20.0 110.997 -174.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.89 168.34 13.78 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.967 1.707 . . . . 20.0 111.402 -179.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.1 t -85.45 -15.26 43.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.626 1.17 . . . . 20.0 112.971 -177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -66.37 167.67 10.14 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.431 1.492 . . . . 20.0 112.056 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.49 178.44 19.98 Favored Glycine 0 CA--C 1.529 0.941 0 C-N-CA 124.873 1.225 . . . . 20.0 112.265 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 110.88 -11.73 29.65 Favored Glycine 0 CA--C 1.533 1.208 0 C-N-CA 125.47 1.509 . . . . 20.0 113.02 -176.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.3 m -67.16 176.33 2.23 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.367 1.467 . . . . 20.0 112.537 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.7 t -101.14 -12.43 18.79 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.722 1.209 . . . . 20.0 111.736 174.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.5 p -139.64 -74.04 0.37 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.939 1.696 . . . . 20.0 109.807 -173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -163.89 143.42 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 125.047 1.339 . . . . 20.0 109.802 -178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.7 t -74.26 139.52 44.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.137 0.975 . . . . 20.0 109.704 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -138.3 124.81 20.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.641 0.776 . . . . 20.0 110.712 -175.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -73.09 82.06 1.27 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.046 0.939 . . . . 20.0 112.45 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.44 -31.67 72.89 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.747 1.219 . . . . 20.0 113.134 -176.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -71.85 -11.98 61.06 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.572 1.149 . . . . 20.0 112.832 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.6 mttm -125.09 5.04 7.9 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.8 1.64 . . . . 20.0 112.957 -178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -46.02 14.86 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.996 1.718 . . . . 20.0 109.964 177.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -141.28 -47.47 0.39 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.741 1.616 . . . . 20.0 111.048 -176.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 112.85 -31.98 6.47 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 125.96 1.743 . . . . 20.0 113.138 -178.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.469 ' HA ' HD11 ' A' ' 57' ' ' LEU . 3.2 t -75.9 -22.13 56.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 118.446 1.123 . . . . 20.0 113.115 174.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.7 tttm 65.1 23.78 12.42 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.674 1.59 . . . . 20.0 113.087 161.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -150.37 113.92 0.62 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 125.111 1.338 . . . . 20.0 110.751 177.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 8.1 ttpt 60.99 11.85 3.58 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 128.757 2.823 . . . . 20.0 114.916 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 -11.98 70.15 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 126.25 1.881 . . . . 20.0 112.865 -173.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.5 108.66 0.07 OUTLIER Glycine 0 CA--C 1.532 1.111 0 C-N-CA 126.212 1.863 . . . . 20.0 113.389 174.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -75.37 179.21 5.33 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.549 1.14 . . . . 20.0 111.021 168.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 10.4 t -137.55 57.34 1.74 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.166 0.986 . . . . 20.0 110.686 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.4 159.25 74.07 Favored Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.956 1.702 . . . . 20.0 112.08 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -67.07 164.12 31.32 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.524 2.816 . . . . 20.0 113.117 -176.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.5 mt -67.27 -16.23 64.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.855 0.862 . . . . 20.0 112.607 172.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -65.87 -25.63 67.27 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.176 1.39 . . . . 20.0 112.763 172.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -68.96 148.62 49.88 Favored 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.923 0.889 . . . . 20.0 111.089 -175.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -88.33 9.1 24.45 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.286 1.034 . . . . 20.0 113.272 -178.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 4.4 t -60.24 169.23 1.69 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.166 1.386 . . . . 20.0 112.011 175.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -146.39 114.57 6.63 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.696 1.998 . . . . 20.0 108.354 -171.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -152.96 176.18 12.14 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.291 0.567 . . . . 20.0 112.129 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.472 HD12 ' H ' ' A' ' 60' ' ' GLU . 0.1 OUTLIER -58.05 140.45 52.49 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.839 1.656 . . . . 20.0 112.847 174.694 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.4 mm-40 -75.32 -9.9 58.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.363 1.865 . . . . 20.0 114.235 174.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.29 -71.91 0.28 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.968 0.907 . . . . 20.0 110.858 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.472 ' H ' HD12 ' A' ' 57' ' ' LEU . 3.8 mm-40 -65.97 -28.11 68.65 Favored 'General case' 0 C--N 1.341 0.209 0 C-N-CA 125.114 1.366 . . . . 20.0 113.056 -178.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 83.7 p -66.6 -41.51 88.36 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.351 0.5 . . . . 20.0 112.351 177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.14 -19.74 63.2 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.733 0.813 . . . . 20.0 112.212 174.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 71.2 m -90.74 -17.27 26.98 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.386 1.474 . . . . 20.0 112.86 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.98 -45.27 74.63 Favored 'General case' 0 C--N 1.347 0.486 0 C-N-CA 125.058 1.343 . . . . 20.0 110.241 176.303 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 142.33 175.4 15.59 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.292 0.948 . . . . 20.0 113.035 170.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -79.54 73.89 6.21 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.918 1.287 . . . . 20.0 109.204 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 162.32 -18.1 0.16 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 125.042 1.306 . . . . 20.0 113.127 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -146.57 174.42 11.44 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 125.534 1.533 . . . . 20.0 112.288 -176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.0 pttm -157.06 162.94 39.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.011 1.724 . . . . 20.0 112.122 -171.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.5 t -69.05 153.06 44.41 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 118.213 0.461 . . . . 20.0 110.481 169.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.9 t -152.56 159.07 43.3 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.384 1.474 . . . . 20.0 109.886 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.4 t -145.92 160.15 11.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 C-N-CA 127.104 2.161 . . . . 20.0 107.53 175.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 58.98 19.01 6.74 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.645 1.978 . . . . 20.0 114.508 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.71 119.08 8.59 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.32 1.848 . . . . 20.0 111.209 -177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 . . . . . 0 C--O 1.251 1.182 0 C-N-CA 124.321 1.049 . . . . 20.0 110.111 -177.636 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 109.289 -0.634 . . . . 20.0 109.289 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -67.75 -37.28 81.91 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 122.57 0.348 . . . . 20.0 111.318 -175.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.0 t -65.28 -41.4 94.21 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.337 1.455 . . . . 20.0 112.098 -177.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 73.4 t -77.0 -40.18 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 123.996 0.918 . . . . 20.0 110.822 176.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.9 t -62.46 -36.27 81.93 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.781 1.232 . . . . 20.0 112.628 -179.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -76.04 -6.43 51.03 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.757 1.223 . . . . 20.0 113.341 175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.37 25.4 21.42 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.799 -1.001 . . . . 20.0 113.977 171.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -111.13 174.62 5.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.542 1.137 . . . . 20.0 111.594 -177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -118.79 178.03 16.57 Favored Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.033 1.302 . . . . 20.0 113.063 -171.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.9 m -123.51 69.33 1.03 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.242 1.417 . . . . 20.0 109.96 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.3 mp -71.82 155.47 92.12 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 124.715 1.206 . . . . 20.0 109.29 171.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -72.01 162.01 43.1 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.162 2.575 . . . . 20.0 110.632 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -65.08 -24.38 67.43 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.209 0.604 . . . . 20.0 112.14 175.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.7 t -63.11 -39.43 94.68 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.689 1.196 . . . . 20.0 112.016 175.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -96.86 -47.8 5.7 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.412 1.085 . . . . 20.0 111.768 -176.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 48.7 t -62.13 118.12 36.42 Favored Pre-proline 0 CA--C 1.537 0.473 0 C-N-CA 125.36 1.464 . . . . 20.0 110.771 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -70.06 158.0 57.97 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.736 2.291 . . . . 20.0 110.355 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 59.3 mt-30 -77.84 -9.95 59.31 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.296 1.039 . . . . 20.0 112.708 -167.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -78.88 -37.71 39.5 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.306 2.242 . . . . 20.0 112.014 172.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.21 -5.05 55.46 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.413 1.485 . . . . 20.0 113.85 -178.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -74.71 100.86 4.11 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.877 0.871 . . . . 20.0 111.523 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.6 mt -70.88 175.46 5.05 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.594 1.958 . . . . 20.0 112.605 -178.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 91.4 p -99.75 -6.45 27.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.481 1.112 . . . . 20.0 113.56 177.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -72.34 172.83 9.64 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.328 1.051 . . . . 20.0 111.91 175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.88 170.66 22.38 Favored Glycine 0 CA--C 1.531 1.035 0 C-N-CA 125.075 1.322 . . . . 20.0 111.684 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.54 12.41 3.39 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.176 1.369 . . . . 20.0 113.881 -177.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 89.8 m -108.47 176.28 5.17 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 125.473 1.509 . . . . 20.0 111.856 177.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.1 m -110.31 -4.0 15.9 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.768 1.227 . . . . 20.0 111.912 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 p -137.16 -72.19 0.43 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.069 1.748 . . . . 20.0 109.634 176.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -160.12 143.24 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 124.681 1.193 . . . . 20.0 110.23 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 15.4 m -73.57 129.29 37.66 Favored 'General case' 0 C--N 1.342 0.28 0 C-N-CA 124.573 1.149 . . . . 20.0 110.245 172.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 2.3 t -131.11 113.55 14.05 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.434 1.094 . . . . 20.0 110.901 -174.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -63.52 108.24 1.32 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.992 2.117 . . . . 20.0 110.921 178.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.2 mt -83.04 -18.97 37.84 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.77 1.228 . . . . 20.0 113.272 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 59.5 p -78.75 -12.1 60.01 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.634 0.976 . . . . 20.0 113.634 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.28 5.11 23.38 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.053 1.741 . . . . 20.0 112.813 171.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 21.8 tp -107.94 -42.3 4.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.23 1.812 . . . . 20.0 110.765 -175.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 6.2 t -152.09 174.74 13.33 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.527 1.531 . . . . 20.0 111.435 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.19 170.35 27.14 Favored Glycine 0 CA--C 1.531 1.074 0 C-N-CA 125.869 1.699 . . . . 20.0 114.158 168.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 20.0 m -71.67 -54.64 9.69 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.762 1.225 . . . . 20.0 110.895 174.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.1 tptt 48.13 29.0 1.67 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 128.028 2.531 . . . . 20.0 115.447 179.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 102.9 -110.56 3.76 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 126.095 1.807 . . . . 20.0 110.198 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 tttm 65.32 6.75 3.81 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 128.95 2.9 . . . . 20.0 114.459 -178.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 103.33 1.9 47.62 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 126.293 1.901 . . . . 20.0 112.916 -171.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.29 169.76 39.5 Favored Glycine 0 C--N 1.343 0.917 0 C-N-CA 125.708 1.623 . . . . 20.0 114.201 -179.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -153.54 -179.4 7.74 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 114.077 1.14 . . . . 20.0 114.077 -169.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 66.0 m -113.1 82.26 1.63 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.917 2.087 . . . . 20.0 109.981 177.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.8 165.88 29.94 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 125.204 1.402 . . . . 20.0 111.438 173.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -67.66 150.98 79.73 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.833 3.022 . . . . 20.0 112.807 -176.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 63.8 mt -63.96 -19.25 65.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.81 1.244 . . . . 20.0 112.409 171.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -67.34 -24.2 65.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.564 1.545 . . . . 20.0 111.928 174.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -84.71 128.35 34.56 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 124.282 1.033 . . . . 20.0 110.243 175.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -67.87 107.45 2.64 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.715 1.606 . . . . 20.0 111.276 -175.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 9.1 t -156.93 -170.26 3.24 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.273 1.829 . . . . 20.0 109.727 177.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -120.15 174.81 6.26 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 126.473 1.909 . . . . 20.0 109.995 175.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -136.27 161.38 35.92 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 125.505 1.522 . . . . 20.0 111.742 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.0 pp -137.18 22.47 3.01 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.994 1.718 . . . . 20.0 114.439 -173.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . 0.254 23.1 pt20 53.92 21.45 2.83 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 130.366 3.466 . . . . 20.0 116.912 166.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -121.75 -87.1 0.64 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.568 1.547 . . . . 20.0 109.977 -170.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -75.45 -27.05 58.76 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.577 0.626 . . . . 20.0 110.928 174.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.6 p -71.42 11.93 0.4 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.73 2.012 . . . . 20.0 113.877 170.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.04 -9.81 8.68 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.909 1.684 . . . . 20.0 112.775 174.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.3 t -86.33 -46.85 9.9 Favored 'General case' 0 C--N 1.345 0.395 0 C-N-CA 124.399 1.08 . . . . 20.0 113.122 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 5.0 m -66.54 -8.7 28.48 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.596 1.559 . . . . 20.0 115.083 -171.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.27 164.76 33.17 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.755 1.645 . . . . 20.0 112.778 -178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -48.34 117.7 2.09 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 125.273 1.429 . . . . 20.0 112.087 -172.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.07 8.4 11.66 Favored Glycine 0 CA--C 1.531 1.058 0 CA-C-O 118.248 -1.307 . . . . 20.0 113.009 -171.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 2.5 pm0 -105.36 153.49 21.58 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.467 1.634 . . . . 20.0 112.622 177.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -155.23 166.52 33.29 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.955 2.102 . . . . 20.0 109.486 162.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.6 t -128.09 133.69 49.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.072 0.949 . . . . 20.0 111.045 -175.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 82.6 m -133.81 77.89 1.74 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.331 1.452 . . . . 20.0 109.638 -168.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 39.9 t -135.62 96.9 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.901 0.881 . . . . 20.0 108.81 -172.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.97 -179.68 4.49 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.969 1.708 . . . . 20.0 110.779 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -120.2 176.31 5.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.886 1.674 . . . . 20.0 112.003 -179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.7 t60 . . . . . 0 C--O 1.252 1.229 0 CA-C-O 116.728 -1.606 . . . . 20.0 111.825 -177.944 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 . . . . . 0 N--CA 1.478 0.935 0 CA-C-O 120.303 0.097 . . . . 20.0 110.869 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.4 tp10 -122.32 -44.06 2.28 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.453 1.101 . . . . 20.0 111.472 -175.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 53.2 t -58.34 -56.33 23.51 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.964 1.306 . . . . 20.0 111.205 177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.1 t -72.36 -28.25 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 C-N-CA 125.643 1.577 . . . . 20.0 111.006 -178.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.3 t -66.72 -38.31 86.45 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.308 1.043 . . . . 20.0 111.685 175.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -75.05 -10.54 59.57 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.566 1.146 . . . . 20.0 112.886 170.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.71 1.16 62.01 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.841 1.21 . . . . 20.0 114.817 172.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -73.01 175.26 6.82 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.423 1.112 . . . . 20.0 111.561 175.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -106.32 166.91 13.97 Favored Glycine 0 CA--C 1.53 1.007 0 C-N-CA 124.873 1.225 . . . . 20.0 112.226 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -118.71 69.17 0.8 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.245 1.418 . . . . 20.0 109.202 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.18 156.18 90.9 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 124.99 1.316 . . . . 20.0 109.69 175.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.48 161.77 44.6 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.658 2.239 . . . . 20.0 111.215 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -63.54 -24.61 67.88 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.031 0.932 . . . . 20.0 112.148 177.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 p -65.99 -46.56 77.55 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.836 1.254 . . . . 20.0 111.982 173.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -80.77 -52.58 7.35 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.553 1.141 . . . . 20.0 111.558 -176.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 25.4 t -67.94 120.35 73.35 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.903 1.281 . . . . 20.0 110.657 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -69.31 161.49 45.66 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.316 2.677 . . . . 20.0 110.845 175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -70.71 -21.08 62.6 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.008 1.323 . . . . 20.0 112.696 -166.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -75.22 -39.46 59.98 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.877 2.471 . . . . 20.0 112.113 176.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -80.08 -5.21 55.48 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.083 1.353 . . . . 20.0 113.415 -177.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.98 102.39 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 124.291 1.036 . . . . 20.0 110.646 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 28.6 mt -72.41 170.19 14.77 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.53 1.132 . . . . 20.0 111.983 178.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.4 t -91.91 -9.69 42.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.286 1.434 . . . . 20.0 112.698 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -71.41 159.88 33.75 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.693 1.197 . . . . 20.0 112.358 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -112.8 -179.5 19.49 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.7 1.619 . . . . 20.0 112.802 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 105.43 -5.75 41.4 Favored Glycine 0 CA--C 1.535 1.304 0 C-N-CA 125.382 1.467 . . . . 20.0 114.071 177.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 84.5 m -82.44 178.32 8.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.925 1.29 . . . . 20.0 112.524 176.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.9 m -114.57 -2.35 13.15 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.539 1.536 . . . . 20.0 111.649 175.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.8 p -138.64 -74.25 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.225 1.81 . . . . 20.0 109.841 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.1 p -166.74 143.61 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 126.526 1.93 . . . . 20.0 108.967 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 10.6 t -76.05 145.08 40.42 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.48 0.712 . . . . 20.0 110.265 173.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 t -137.09 118.66 14.88 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.854 0.861 . . . . 20.0 110.304 -176.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.48 93.13 0.33 Allowed 'General case' 0 C--N 1.346 0.417 0 C-N-CA 123.793 0.837 . . . . 20.0 111.665 178.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 24.1 mt -67.31 -28.22 67.81 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.494 0.717 . . . . 20.0 111.65 179.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.4 t -78.38 -11.74 59.96 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.496 1.518 . . . . 20.0 113.226 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -132.17 8.14 4.34 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.806 1.242 . . . . 20.0 113.465 -176.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.18 -36.2 79.21 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.208 1.803 . . . . 20.0 112.093 -176.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 80.7 p -118.02 -37.92 3.31 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.645 1.578 . . . . 20.0 112.305 -173.088 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 68.38 -161.96 50.13 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.294 0.949 . . . . 20.0 113.213 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.2 t -62.97 -66.46 0.54 Allowed 'General case' 0 C--N 1.342 0.243 0 C-N-CA 124.297 1.039 . . . . 20.0 109.88 169.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.8 tttm 55.79 15.3 1.59 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 127.563 2.345 . . . . 20.0 114.84 -176.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.61 -32.19 7.49 Favored Glycine 0 CA--C 1.531 1.09 0 C-N-CA 126.955 2.217 . . . . 20.0 112.388 -176.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm 62.04 9.65 3.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 129.328 3.051 . . . . 20.0 114.736 172.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.77 6.96 66.96 Favored Glycine 0 CA--C 1.537 1.42 0 C-N-CA 126.029 1.776 . . . . 20.0 113.712 -174.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.43 -161.05 4.36 Favored Glycine 0 C--N 1.343 0.947 0 C-N-CA 126.618 2.056 . . . . 20.0 114.021 178.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -130.53 171.45 13.0 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 122.95 0.5 . . . . 20.0 112.272 178.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 48.2 t -98.57 107.58 20.06 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.96 0.904 . . . . 20.0 110.421 177.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -137.21 156.51 75.38 Favored Pre-proline 0 CA--C 1.544 0.731 0 C-N-CA 127.878 2.471 . . . . 20.0 109.518 -175.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.69 164.69 30.29 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.593 2.862 . . . . 20.0 113.494 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 69' ' ' LYS . 91.4 mt -61.55 -21.14 64.01 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.682 1.593 . . . . 20.0 112.702 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -98.8 9.9 42.41 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.843 1.657 . . . . 20.0 113.337 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.4 tpt85 -74.78 33.13 0.09 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.442 1.897 . . . . 20.0 112.985 175.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.28 -8.69 0.25 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 129.568 3.147 . . . . 20.0 114.459 -178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 59.3 m -74.29 148.84 41.07 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 125.554 1.542 . . . . 20.0 111.274 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 16.3 tptm -150.26 116.25 5.62 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.352 1.461 . . . . 20.0 110.493 173.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.448 ' HG3' ' H ' ' A' ' 57' ' ' LEU . 5.3 tp10 -160.26 -173.97 4.29 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.328 1.451 . . . . 20.0 109.97 178.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.448 ' H ' ' HG3' ' A' ' 56' ' ' GLU . 4.0 pp -56.94 158.47 4.84 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.252 1.821 . . . . 20.0 113.061 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -121.17 -0.52 9.93 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.931 2.092 . . . . 20.0 113.692 174.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -66.92 -9.56 39.48 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.748 1.619 . . . . 20.0 114.623 176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -135.07 -42.66 0.73 Allowed 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.208 1.403 . . . . 20.0 111.44 -179.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 60.2 p -63.43 -16.45 60.59 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.356 1.462 . . . . 20.0 113.907 -176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.81 -2.3 0.53 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.011 2.124 . . . . 20.0 114.009 171.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.0 m -56.97 -39.73 75.15 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.2 1.8 . . . . 20.0 112.748 172.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 3.5 t -76.46 -15.76 59.83 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-N 119.058 0.845 . . . . 20.0 112.684 173.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 105.45 -175.54 21.88 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 126.099 1.809 . . . . 20.0 111.365 -171.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -65.47 99.86 0.45 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.567 1.547 . . . . 20.0 109.642 175.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.07 -24.85 0.61 Allowed Glycine 0 CA--C 1.531 1.078 0 C-N-CA 125.182 1.372 . . . . 20.0 112.832 -175.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -105.08 138.51 41.17 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 118.993 1.397 . . . . 20.0 111.672 -175.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD2' ' HA ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -133.48 138.64 46.25 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.838 2.455 . . . . 20.0 110.746 175.682 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.0 t -55.6 110.76 0.76 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.544 1.138 . . . . 20.0 111.428 -177.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 6.9 t -138.92 72.38 1.4 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 123.415 0.686 . . . . 20.0 112.348 -169.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 45.8 t -141.47 113.89 4.12 Favored 'Isoleucine or valine' 0 C--N 1.338 0.1 0 C-N-CA 124.749 1.22 . . . . 20.0 109.42 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 2.7 m-90 -79.27 -8.46 59.06 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.711 1.604 . . . . 20.0 113.869 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 13.4 tp -82.38 160.12 22.86 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.896 2.078 . . . . 20.0 110.37 177.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.3 t60 . . . . . 0 C--O 1.25 1.126 0 C-N-CA 127.314 2.245 . . . . 20.0 112.518 174.811 . . . . . . . . 0 0 . 1 stop_ save_