data_2ewl_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 2ewl _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 ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.441 -0.896 0 CA-C-O 117.557 -1.211 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -54.05 89.17 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -128.97 133.23 47.72 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.662 1.185 . . . . 0.0 108.748 -168.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.48 94.89 5.57 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.261 1.024 . . . . 0.0 109.327 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.3 mt -96.41 98.66 7.91 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.391 0.2 OUTLIER -84.1 124.33 31.0 Favored 'General case' 0 N--CA 1.439 -0.99 0 O-C-N 120.816 -1.177 . . . . 0.0 111.688 -177.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.1 t -120.5 -154.94 0.6 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.284 2.234 . . . . 0.0 108.055 172.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.427 ' CG1' HH21 ' A' ' 22' ' ' ARG . 13.4 m -137.17 159.97 36.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 O-C-N 120.502 -1.374 . . . . 0.0 111.22 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.2 t -66.02 110.97 3.13 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -56.91 -11.51 1.5 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.617 1.967 . . . . 0.0 114.232 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -121.21 -14.66 8.31 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -175.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -125.66 2.79 7.53 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.08 1.309 . . . . 0.0 113.778 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.3 t70 58.13 15.91 3.55 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.861 2.464 . . . . 0.0 113.678 -177.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.06 146.83 28.35 Favored Glycine 0 C--N 1.342 0.871 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -174.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.427 HH21 ' CG1' ' A' ' 15' ' ' VAL . 1.8 tpp85 -70.92 119.14 14.61 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 124.548 1.139 . . . . 0.0 110.573 -166.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 78.6 mt -109.26 100.11 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 169.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.29 97.18 1.53 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 163.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.69 82.92 0.87 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.0 m -69.97 102.17 1.95 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -118.55 172.94 5.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 C-N-CA 124.676 1.19 . . . . 0.0 108.619 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -120.98 92.91 3.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 165.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -133.31 131.08 39.74 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.789 0.835 . . . . 0.0 109.118 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 m -62.53 162.21 10.73 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.4 62.41 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 122.904 0.482 . . . . 0.0 112.254 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -75.19 -33.98 61.49 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -67.09 -45.66 76.6 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.37 0.668 . . . . 0.0 109.421 171.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.97 -44.0 86.81 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.567 0.747 . . . . 0.0 110.158 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.79 -53.43 54.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.807 1.243 . . . . 0.0 109.392 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.6 m -59.05 -51.13 71.38 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.788 0.835 . . . . 0.0 109.984 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.16 -28.46 68.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.582 -0.723 . . . . 0.0 110.583 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -50.87 69.38 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 118.826 0.739 . . . . 0.0 109.326 170.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -62.54 -41.05 98.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -175.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.91 -49.13 77.42 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.172 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.36 -34.07 77.13 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.352 0.524 . . . . 0.0 111.635 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.0 tt -66.61 -38.67 87.45 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.191 0.996 . . . . 0.0 110.816 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.8 t -70.88 -67.57 0.5 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.331 1.452 . . . . 0.0 111.452 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -153.89 -36.63 0.1 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -158.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 tp -66.12 148.0 52.48 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.524 0.678 . . . . 0.0 109.604 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.8 m -160.5 168.14 25.72 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -121.02 174.02 6.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.853 1.661 . . . . 0.0 107.881 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.0 m -133.22 148.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 C-N-CA 126.588 1.955 . . . . 0.0 108.164 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.6 p -75.28 157.04 85.32 Favored Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -64.2 -27.0 64.45 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.188 1.925 . . . . 0.0 113.128 -174.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 43.0 t90 -58.5 -59.88 4.68 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.008 0.523 . . . . 0.0 109.767 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.2 m -58.77 -42.86 89.96 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.799 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.44 68.43 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.137 0.881 . . . . 0.0 112.409 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.1 m -79.68 -35.98 38.36 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.806 0.843 . . . . 0.0 111.241 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.77 -49.19 10.7 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 118.591 -0.719 . . . . 0.0 111.418 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 . . . . . 0 C--O 1.25 1.109 1 C-N-CA 133.966 4.907 . . . . 0.0 108.961 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.67 101.31 0.07 Allowed 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.229 1.412 . . . . 0.0 111.532 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -126.38 152.18 46.65 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.333 1.453 . . . . 0.0 109.125 -173.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -125.51 96.35 4.77 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.0 mt -97.31 97.76 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -171.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.88 102.34 0.77 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 p -98.9 -172.27 2.26 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 162.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -130.7 151.69 36.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 121.779 0.8 . . . . 0.0 110.565 174.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -70.27 106.38 3.32 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.283 1.833 . . . . 0.0 108.335 162.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -59.9 -8.73 2.38 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 114.141 -174.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -114.1 -14.74 12.34 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.9 p -122.09 -0.82 9.38 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.005 1.275 . . . . 0.0 113.307 170.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.8 t0 50.97 23.33 1.44 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.514 2.325 . . . . 0.0 112.782 -169.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.63 137.46 18.16 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -76.42 139.12 40.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.231 -0.984 . . . . 0.0 109.807 -170.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.0 mt -130.42 98.62 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -72.8 87.89 1.3 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.502 1.521 . . . . 0.0 109.552 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.0 mt -70.22 86.68 0.58 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.845 0.858 . . . . 0.0 108.79 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.3 m -72.2 105.25 3.93 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 169.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.6 m -124.28 173.49 10.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 125.365 1.466 . . . . 0.0 109.204 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -125.11 99.76 6.25 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -157.95 130.26 7.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.693 -1.255 . . . . 0.0 108.634 -164.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 m -65.67 165.77 11.93 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -158.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.0 46.89 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.193 1.397 . . . . 0.0 113.635 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.14 -50.84 62.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -54.56 -44.79 73.23 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.874 0.87 . . . . 0.0 110.543 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.48 -48.68 76.61 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.259 0.624 . . . . 0.0 110.662 174.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.463 ' HE ' ' NE2' ' A' ' 39' ' ' GLN . 0.3 OUTLIER -62.15 -53.93 48.35 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 m -58.97 -49.87 76.24 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 124.162 0.985 . . . . 0.0 110.467 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.91 -32.72 74.56 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.32 0.964 . . . . 0.0 111.493 176.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -57.86 -45.84 85.7 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 173.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.463 ' NE2' ' HE ' ' A' ' 35' ' ' ARG . 14.7 mm-40 -60.19 -42.05 94.21 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 118.909 0.777 . . . . 0.0 110.364 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.9 mt -59.48 -49.96 75.75 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.109 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -65.97 -33.36 75.64 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.174 0.443 . . . . 0.0 111.61 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.26 -38.59 90.79 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.829 0.74 . . . . 0.0 111.391 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.413 ' C ' ' HG1' ' A' ' 44' ' ' THR . 14.6 t -74.31 -58.94 2.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.63 1.172 . . . . 0.0 111.168 -174.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.413 ' HG1' ' C ' ' A' ' 43' ' ' SER . 54.1 m -163.37 -23.24 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.45 142.97 58.24 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 120.074 1.307 . . . . 0.0 110.056 -173.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.3 m -155.79 166.72 32.64 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 165.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -119.77 -172.88 2.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -165.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.52 126.86 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.4 p -68.73 150.32 97.67 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.93 -28.66 66.87 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.143 1.895 . . . . 0.0 113.523 -169.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -61.44 -49.82 75.29 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.808 0.443 . . . . 0.0 110.792 171.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.6 m -68.15 -32.78 73.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.842 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.01 -32.08 73.63 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 120.012 1.278 . . . . 0.0 111.437 173.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.8 m -76.48 -49.74 15.81 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.428 1.091 . . . . 0.0 110.928 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -85.69 -16.72 38.14 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.767 0.827 . . . . 0.0 112.544 -173.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 131.038 3.735 . . . . 0.0 114.956 -177.985 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.622 0 CA-C-O 118.058 -0.973 . . . . 0.0 111.22 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -53.3 92.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.478 2.311 . . . . 0.0 112.586 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -126.47 160.92 29.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.138 0.975 . . . . 0.0 110.167 -175.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -133.45 98.09 4.13 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.275 -0.89 . . . . 0.0 110.254 -168.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.2 mm -86.95 100.22 9.51 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.83 86.75 0.13 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.108 0.963 . . . . 0.0 109.68 173.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.4 t -89.26 176.73 6.83 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.332 1.453 . . . . 0.0 110.018 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -123.75 158.48 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.322 1.049 . . . . 0.0 110.318 163.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -73.99 115.16 13.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.637 1.975 . . . . 0.0 109.351 169.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.5 t -55.95 -24.44 38.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.066 1.746 . . . . 0.0 113.977 -173.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.44 -41.87 9.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.88 1.218 . . . . 0.0 112.723 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -110.93 -3.64 15.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.7 t0 49.8 38.53 15.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.691 1.996 . . . . 0.0 112.054 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.2 144.86 17.37 Favored Glycine 0 C--N 1.341 0.829 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 170.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.5 149.62 28.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.909 -165.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.94 108.46 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -80.31 91.9 5.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.791 0.836 . . . . 0.0 108.762 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -74.81 87.16 2.24 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -176.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -71.45 95.68 1.4 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 171.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -104.62 172.57 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.383 1.473 . . . . 0.0 109.503 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -123.57 107.47 11.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.217 -1.771 . . . . 0.0 106.217 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.3 t -151.17 169.19 22.48 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.998 0.519 . . . . 0.0 109.808 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.6 m -82.34 170.28 15.52 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.555 -1.341 . . . . 0.0 110.643 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.03 74.42 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.186 0.594 . . . . 0.0 111.285 -174.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' A' ' 32' ' ' GLU . 1.7 mp0 -62.3 -52.73 62.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.76 2.024 . . . . 0.0 109.918 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.88 -46.74 77.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.486 1.114 . . . . 0.0 109.818 177.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.96 -47.19 68.32 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.119 0.418 . . . . 0.0 111.065 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -64.72 -49.65 70.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.4 m -58.69 -50.12 75.04 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.445 0.298 . . . . 0.0 110.365 -176.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.89 -31.94 72.87 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.875 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.23 -41.97 89.92 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 119.611 1.096 . . . . 0.0 108.724 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -63.67 -43.6 96.22 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-N 119.264 0.938 . . . . 0.0 110.313 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.42 -42.7 99.15 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.261 0.482 . . . . 0.0 112.002 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -73.89 -30.82 62.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.788 0.435 . . . . 0.0 111.231 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.3 mt -69.44 -35.61 75.85 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.923 0.783 . . . . 0.0 111.131 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.3 t -67.58 -68.9 0.35 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.461 1.505 . . . . 0.0 110.935 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -36.65 0.1 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -158.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.14 153.0 43.67 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.481 0.658 . . . . 0.0 109.76 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.5 m -165.79 167.87 16.54 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 126.017 1.727 . . . . 0.0 107.126 170.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -115.97 -179.72 3.74 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.214 1.405 . . . . 0.0 108.854 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -134.48 132.66 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 126.766 2.027 . . . . 0.0 105.856 -178.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.1 p -70.14 151.52 95.96 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -62.03 -30.95 83.64 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.929 1.752 . . . . 0.0 112.125 -175.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -56.89 -48.68 77.63 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.287 0.494 . . . . 0.0 111.066 171.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.1 m -69.69 -28.32 65.74 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.278 -0.867 . . . . 0.0 112.413 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.65 81.59 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.378 0.99 . . . . 0.0 110.213 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.8 m -65.55 -47.94 74.13 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.868 0.867 . . . . 0.0 112.006 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.62 -24.0 59.97 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.276 0.489 . . . . 0.0 111.669 -176.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 127.596 2.358 . . . . 0.0 112.621 170.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -64.59 101.68 0.48 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.656 1.582 . . . . 0.0 112.73 -172.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -135.48 109.98 8.52 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.152 -1.386 . . . . 0.0 109.989 -159.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -87.11 110.89 20.42 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.91 1.284 . . . . 0.0 108.837 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.0 mt -112.08 98.47 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.87 110.72 2.97 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.218 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.9 t -109.65 -179.21 3.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.407 0.683 . . . . 0.0 109.98 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.3 m -136.95 153.29 29.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 122.051 0.929 . . . . 0.0 112.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.4 t -65.38 119.37 10.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.675 163.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.4 t -56.52 -18.67 12.36 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.29 1.436 . . . . 0.0 114.657 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HE3' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -125.28 -16.92 5.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -164.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.9 p -121.71 0.63 9.87 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.816 0.846 . . . . 0.0 113.072 169.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.59 19.85 4.52 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.302 1.841 . . . . 0.0 112.647 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.0 131.46 36.41 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -71.88 114.67 10.22 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 127.286 2.234 . . . . 0.0 109.621 -169.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.1 mm -110.15 134.57 51.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -105.91 93.28 4.55 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 174.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -79.68 82.49 5.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . 0.339 5.7 t -73.62 103.52 4.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 117.514 -1.674 . . . . 0.0 108.674 161.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.73 172.02 1.19 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 158.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.61 93.71 3.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 160.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.2 t -158.05 171.73 19.71 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.67 0.388 . . . . 0.0 111.256 -167.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.1 t -68.47 166.7 16.32 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.852 0.834 . . . . 0.0 111.678 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.72 72.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.951 1.3 . . . . 0.0 111.369 167.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -68.14 -48.79 64.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.025 0.93 . . . . 0.0 110.057 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -67.94 -46.27 71.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.802 1.241 . . . . 0.0 109.865 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tt -48.91 -51.61 29.09 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 118.348 0.522 . . . . 0.0 110.271 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -59.93 -55.86 28.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 m -53.17 -53.04 56.34 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.193 0.997 . . . . 0.0 110.063 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -34.85 79.21 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.058 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.47 -46.86 88.53 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 117.185 -1.388 . . . . 0.0 109.476 170.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -46.36 82.35 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 121.128 1.785 . . . . 0.0 109.862 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.45 -43.63 69.47 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -67.44 -23.36 65.51 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.35 -34.18 48.58 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.262 1.825 . . . . 0.0 110.844 171.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.3 t -66.75 -67.54 0.44 Allowed 'General case' 0 C--N 1.339 0.152 0 C-N-CA 124.302 1.041 . . . . 0.0 110.287 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -44.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.775 0.83 . . . . 0.0 112.384 -158.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.01 139.09 55.25 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -144.96 161.98 38.03 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -172.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -118.31 68.75 0.78 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 117.963 0.347 . . . . 0.0 110.919 -158.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.33 113.19 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-O 121.64 0.733 . . . . 0.0 109.671 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.1 p -57.97 152.96 36.24 Favored Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 124.21 1.004 . . . . 0.0 110.317 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -63.72 -25.87 68.53 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.303 2.002 . . . . 0.0 113.096 -171.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.3 t90 -60.79 -53.32 58.81 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.292 0.497 . . . . 0.0 109.848 169.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.414 ' SG ' ' HE3' ' A' ' 18' ' ' LYS . 10.0 m -62.62 -36.74 83.76 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.919 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.5 88.61 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.597 0.635 . . . . 0.0 111.296 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 m -74.06 -42.06 60.8 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.306 1.042 . . . . 0.0 111.402 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -86.67 -19.86 28.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.436 0.694 . . . . 0.0 112.336 -172.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.549 2.34 . . . . 0.0 111.156 -173.095 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -55.0 93.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 127.522 2.329 . . . . 0.0 111.478 172.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.6 m170 -125.29 143.97 50.7 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.888 1.275 . . . . 0.0 110.451 -168.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.57 82.19 1.68 Allowed 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.118 0.567 . . . . 0.0 109.711 -176.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.82 100.91 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -72.56 100.06 2.67 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 120.928 -1.107 . . . . 0.0 109.778 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.45 -173.94 4.77 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 160.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.45 159.41 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.641 1.176 . . . . 0.0 110.01 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.27 113.28 9.14 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.769 2.028 . . . . 0.0 108.558 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.4 t -56.9 -18.65 14.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.17 1.788 . . . . 0.0 113.458 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.32 -16.19 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.0 p -129.9 -0.8 4.75 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.749 1.613 . . . . 0.0 114.475 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 55.1 24.06 5.8 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.556 1.943 . . . . 0.0 113.217 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.56 146.37 28.61 Favored Glycine 0 C--N 1.34 0.78 0 N-CA-C 108.714 -1.754 . . . . 0.0 108.714 175.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.79 141.12 39.42 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.613 -166.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mm -121.93 94.09 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -74.25 95.46 2.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.321 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.94 74.06 5.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.3 m -75.39 96.65 3.46 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 167.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.92 157.48 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 C-N-CA 126.143 1.777 . . . . 0.0 108.589 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -104.82 102.59 12.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 -178.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -151.97 156.73 40.61 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 118.057 0.39 . . . . 0.0 110.283 173.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 163.33 21.72 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.234 0.614 . . . . 0.0 111.928 -174.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.61 -34.89 74.91 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.643 0.777 . . . . 0.0 111.329 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.65 -48.92 78.65 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.323 1.849 . . . . 0.0 110.547 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -69.18 -46.99 66.13 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.949 0.9 . . . . 0.0 109.857 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -50.12 -46.14 53.51 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.285 0.634 . . . . 0.0 110.881 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -66.22 -51.79 54.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.8 0.84 . . . . 0.0 109.416 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.6 m -58.05 -51.99 67.39 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.997 0.919 . . . . 0.0 110.078 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.67 -31.44 72.66 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.138 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.39 -51.68 61.78 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.296 0.953 . . . . 0.0 108.871 170.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -59.65 -43.77 93.79 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.31 -47.2 86.28 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.164 0.438 . . . . 0.0 112.053 177.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -71.86 -25.74 62.07 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.034 0.534 . . . . 0.0 112.315 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.97 -43.26 75.33 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.389 0.995 . . . . 0.0 110.561 166.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.433 ' C ' ' HG1' ' A' ' 44' ' ' THR . 10.7 t -66.85 -54.89 17.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.747 1.219 . . . . 0.0 111.22 -172.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.433 ' HG1' ' C ' ' A' ' 43' ' ' SER . 83.2 m -160.25 -27.18 0.06 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 156.78 38.14 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 120.027 1.285 . . . . 0.0 110.685 -171.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.1 m -164.96 171.24 14.26 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.744 1.617 . . . . 0.0 108.35 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -128.38 -179.95 5.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.738 1.215 . . . . 0.0 109.425 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.3 p -147.07 136.83 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.613 1.565 . . . . 0.0 107.146 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.6 p -72.78 154.58 91.17 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.147 -0.454 . . . . 0.0 109.947 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.9 -27.54 58.78 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.34 2.027 . . . . 0.0 112.819 -177.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -58.25 -57.62 12.07 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.063 0.545 . . . . 0.0 109.54 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 m -59.76 -39.5 85.04 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.633 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.537 1.062 . . . . 0.0 111.4 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -76.82 -31.83 57.19 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.455 1.102 . . . . 0.0 111.782 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.98 -6.71 41.75 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.272 1.029 . . . . 0.0 112.705 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.322 14.8 pt20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 129.581 3.152 . . . . 0.0 113.856 -171.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 123.889 1.805 . . . . 0.0 113.483 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -66.12 88.48 0.12 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 110.743 -2.935 . . . . 0.0 108.246 167.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.8 m170 -105.26 173.61 6.23 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.564 1.946 . . . . 0.0 110.683 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.22 93.72 3.64 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 125.345 1.458 . . . . 0.0 107.77 175.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 mt -95.09 100.31 10.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -173.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.8 tt -66.69 112.06 4.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.763 0.825 . . . . 0.0 109.453 175.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 p -108.54 -169.91 1.58 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.125 0.57 . . . . 0.0 110.35 160.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -125.08 165.75 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 122.94 0.496 . . . . 0.0 109.85 165.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.5 t -68.16 124.19 22.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.123 1.369 . . . . 0.0 107.653 160.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.87 -7.05 6.98 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -172.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -137.72 -8.68 1.64 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.6 p -128.75 1.58 5.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.883 1.273 . . . . 0.0 110.469 167.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.73 29.55 9.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.301 2.64 . . . . 0.0 112.49 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.49 141.95 25.32 Favored Glycine 0 C--N 1.339 0.701 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -71.51 120.7 17.46 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 126.766 2.026 . . . . 0.0 110.586 -170.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.53 106.98 18.58 Favored 'Isoleucine or valine' 0 C--N 1.346 0.428 0 CA-C-N 119.928 1.24 . . . . 0.0 108.175 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -79.86 92.46 5.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.832 0.853 . . . . 0.0 109.362 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.4 mt -69.45 90.18 0.52 Allowed 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.1 m -74.88 100.37 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.72 154.2 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 124.421 1.089 . . . . 0.0 109.325 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -113.8 110.11 19.62 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.2 m -155.15 112.6 3.35 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -160.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.4 m -71.13 156.48 39.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.978 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.96 -38.48 62.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -166.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.95 -56.2 9.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.722 1.209 . . . . 0.0 110.664 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -56.97 -38.04 72.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.355 1.862 . . . . 0.0 111.402 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.22 -42.95 96.37 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.381 1.472 . . . . 0.0 109.174 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.92 -42.51 98.25 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.314 0.646 . . . . 0.0 110.367 173.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.6 m -60.96 -54.47 44.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.757 0.708 . . . . 0.0 110.196 175.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.42 -29.64 68.35 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.989 0.813 . . . . 0.0 111.891 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -55.74 -51.4 67.49 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 125.72 1.608 . . . . 0.0 108.183 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -70.63 -33.38 70.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.013 0.525 . . . . 0.0 111.102 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.13 -50.48 71.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.53 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -62.94 -34.63 77.88 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.801 0.728 . . . . 0.0 111.446 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 tt -68.62 -37.78 80.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 0.0 110.711 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 t -70.83 -69.34 0.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.575 1.55 . . . . 0.0 111.796 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -154.9 -32.08 0.1 Allowed 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -158.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.7 tp -64.09 129.12 38.73 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.355 0.662 . . . . 0.0 109.531 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -133.87 166.5 22.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 168.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -122.89 167.45 13.54 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.271 1.428 . . . . 0.0 107.961 -174.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.2 t -140.13 132.67 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -174.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.8 p -69.31 153.43 95.9 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.6 -28.93 69.87 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.096 1.864 . . . . 0.0 113.086 -172.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -59.72 -60.31 4.04 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.521 0.601 . . . . 0.0 109.71 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.5 m -54.96 -43.8 73.8 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.902 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.57 74.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.812 0.733 . . . . 0.0 111.997 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.37 -25.15 39.32 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.345 1.058 . . . . 0.0 112.007 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -104.75 -12.27 16.41 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.614 0.765 . . . . 0.0 112.841 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 116.925 -1.512 . . . . 0.0 112.869 169.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 . . . . . 0 N--CA 1.441 -0.912 0 CA-C-O 117.1 -1.429 . . . . 0.0 112.89 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 110.16 0.7 Allowed 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 121.227 1.83 . . . . 0.0 110.739 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.44 164.8 28.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.524 -1.216 . . . . 0.0 108.721 -176.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.16 117.11 17.07 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -114.79 100.75 11.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.9 tp -72.05 86.24 1.03 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.609 1.964 . . . . 0.0 110.152 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -90.12 -171.66 3.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.458 0.703 . . . . 0.0 109.422 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.93 154.2 39.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 123.181 0.592 . . . . 0.0 110.526 170.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.86 106.47 2.3 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.717 1.207 . . . . 0.0 107.792 162.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.19 -3.18 0.79 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -172.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.65 -16.94 11.23 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 30.5 p -120.05 2.41 10.95 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.117 1.326 . . . . 0.0 112.688 170.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.2 t0 54.21 21.35 3.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.436 2.294 . . . . 0.0 112.578 -171.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.42 129.15 16.73 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -55.32 113.1 1.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 129.254 3.022 . . . . 0.0 108.681 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.251 0.6 OUTLIER -126.55 106.49 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 122.679 1.228 . . . . 0.0 109.327 -172.387 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -87.5 94.26 9.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.254 1.021 . . . . 0.0 109.097 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.65 87.04 1.65 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.9 m -71.79 101.79 2.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 170.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.9 m -107.33 170.41 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.046 1.338 . . . . 0.0 108.463 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -134.25 83.7 2.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 168.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.7 t -154.96 156.7 36.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.712 0.805 . . . . 0.0 109.498 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -72.38 166.28 22.85 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.717 0.807 . . . . 0.0 112.037 -172.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.07 -39.92 63.66 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.077 1.351 . . . . 0.0 113.708 -172.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.43 -42.08 88.22 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.93 0.892 . . . . 0.0 111.369 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -74.07 -41.45 61.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.749 0.82 . . . . 0.0 110.124 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.18 -50.48 49.16 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.287 0.635 . . . . 0.0 110.46 167.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.0 ttt-85 -64.63 -41.95 95.82 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 124.418 1.087 . . . . 0.0 110.628 -177.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 m -63.08 -53.81 47.76 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.817 0.447 . . . . 0.0 110.66 176.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.63 -30.85 69.66 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.144 0.577 . . . . 0.0 110.844 -174.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.13 -59.79 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.262 1.425 . . . . 0.0 108.098 164.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -59.94 -35.72 75.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 117.083 -1.437 . . . . 0.0 111.705 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -46.99 68.63 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.278 1.399 . . . . 0.0 113.903 167.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -67.1 -1.53 4.38 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -114.88 -27.91 7.24 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 126.356 1.862 . . . . 0.0 108.478 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.3 p -77.05 -52.31 9.54 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.257 0.551 . . . . 0.0 111.175 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -157.11 -39.93 0.07 Allowed 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.845 1.258 . . . . 0.0 113.007 -158.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.62 163.17 23.84 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.266 0.555 . . . . 0.0 110.198 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -144.69 170.45 16.07 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 168.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -91.1 -30.18 16.88 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.064 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.4 t 57.48 104.72 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 127.263 2.225 . . . . 0.0 111.942 -175.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.03 150.0 31.91 Favored Pre-proline 0 CA--C 1.537 0.472 0 O-C-N 121.352 -0.842 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.43 -25.72 63.27 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.27 1.98 . . . . 0.0 113.053 -172.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.99 -49.79 76.28 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 169.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 41.7 m -67.6 -34.06 76.25 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.828 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.48 67.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.998 1.272 . . . . 0.0 111.814 174.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -86.08 -52.56 5.61 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.881 1.272 . . . . 0.0 111.043 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -83.6 -18.4 38.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.373 1.069 . . . . 0.0 112.526 -171.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 . . . . . 0 C--O 1.248 0.991 0 C-N-CA 129.752 3.221 . . . . 0.0 113.606 171.646 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -52.74 100.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.657 1.583 . . . . 0.0 111.177 173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -130.13 153.43 48.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.878 1.271 . . . . 0.0 109.546 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -121.88 118.05 27.99 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.978 0.911 . . . . 0.0 108.653 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.5 mt -117.73 101.12 11.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.38 105.38 3.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.314 -0.867 . . . . 0.0 109.323 172.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.0 t -102.52 -179.76 4.07 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.406 1.082 . . . . 0.0 108.387 169.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -131.5 156.46 42.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.828 0.823 . . . . 0.0 109.292 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.31 99.71 2.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 162.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -58.78 -2.05 0.2 Allowed 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.194 1.554 . . . . 0.0 115.194 -173.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -114.69 -14.3 12.03 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.049 1.34 . . . . 0.0 114.449 177.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.4 p -126.08 1.32 7.22 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.565 1.529 . . . . 0.0 113.688 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.2 t0 52.4 25.57 3.59 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.446 2.698 . . . . 0.0 113.668 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.75 137.78 26.21 Favored Glycine 0 C--N 1.34 0.759 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.479 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -70.76 124.01 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 126.528 1.931 . . . . 0.0 109.201 -176.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.44 97.36 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.479 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 40.3 tt0 -79.26 95.43 5.66 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.08 80.61 2.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -177.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -70.16 100.79 1.72 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 164.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.3 m -113.96 173.59 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 125.057 1.343 . . . . 0.0 108.977 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -124.35 104.44 8.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 162.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.6 t -154.43 155.5 35.08 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.013 0.824 . . . . 0.0 111.136 175.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.0 m -70.24 160.66 31.76 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.773 0.829 . . . . 0.0 111.626 -176.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.57 -42.36 67.49 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.307 1.043 . . . . 0.0 113.008 -173.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -70.53 -41.94 71.88 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.791 0.437 . . . . 0.0 111.12 -171.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.43 -47.46 79.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.843 0.857 . . . . 0.0 109.609 171.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tt -54.71 -40.4 69.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.89 -0.506 . . . . 0.0 111.504 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -70.22 -40.8 74.31 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 121.133 -0.979 . . . . 0.0 111.471 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.9 m -65.73 -47.95 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.567 0.747 . . . . 0.0 110.327 177.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.03 -34.48 59.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -171.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.23 -47.92 80.41 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 118.127 -0.94 . . . . 0.0 108.933 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.09 -33.4 75.4 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.2 -1.4 . . . . 0.0 112.098 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.9 -42.93 89.6 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 118.497 -1.281 . . . . 0.0 110.03 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -69.42 -27.28 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.985 0.914 . . . . 0.0 112.295 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.29 -39.26 65.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.474 0.71 . . . . 0.0 110.983 171.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.7 t -71.73 -69.11 0.41 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.992 1.717 . . . . 0.0 111.943 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.85 -35.63 0.11 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -158.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.16 165.54 23.38 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -146.49 172.75 13.07 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 125.311 1.444 . . . . 0.0 107.722 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -79.53 -50.35 10.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.911 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t 66.19 125.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.589 2.356 . . . . 0.0 111.269 -172.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.9 p -71.49 152.72 93.92 Favored Pre-proline 0 CA--C 1.538 0.506 0 O-C-N 120.934 -1.104 . . . . 0.0 109.961 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.76 -25.48 60.91 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.228 1.952 . . . . 0.0 112.94 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.94 -56.39 22.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.289 0.495 . . . . 0.0 109.733 170.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.8 m -63.57 -35.59 80.99 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.471 0.578 . . . . 0.0 111.773 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.65 71.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.569 1.077 . . . . 0.0 111.545 174.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.6 m -80.56 -42.65 21.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.281 1.032 . . . . 0.0 111.389 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -85.55 -18.5 33.24 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.662 0.785 . . . . 0.0 112.573 -173.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 130.653 3.581 . . . . 0.0 110.779 -173.449 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.3 mm-40 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -61.04 86.0 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 129.075 2.95 . . . . 0.0 111.774 -172.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -122.21 152.45 39.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.178 1.391 . . . . 0.0 109.196 -171.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.74 101.79 6.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.5 mt -107.82 102.13 13.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -74.37 103.19 4.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.239 -0.913 . . . . 0.0 109.933 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.3 t -96.17 -177.45 3.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.226 1.41 . . . . 0.0 108.562 168.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.16 158.74 42.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.915 0.864 . . . . 0.0 110.486 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.1 t -74.56 98.95 3.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 164.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 29.3 t -57.37 -15.4 6.39 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -172.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -95.54 -15.36 22.91 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 117.55 -1.214 . . . . 0.0 114.051 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -129.4 1.05 5.08 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 120.588 1.54 . . . . 0.0 114.134 175.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t0 52.43 22.56 2.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 128.349 2.659 . . . . 0.0 113.423 -171.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.45 143.28 38.64 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.92 118.58 14.95 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.071 2.148 . . . . 0.0 110.21 -173.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.0 mt -124.69 90.82 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-O 122.143 0.973 . . . . 0.0 108.78 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.33 100.8 0.86 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.575 1.15 . . . . 0.0 109.71 170.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 mt -79.82 73.47 6.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -69.09 102.16 1.58 Allowed 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.5 m -124.08 170.92 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 125.611 1.564 . . . . 0.0 108.908 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -120.91 99.49 6.54 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 t -150.89 156.24 40.81 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-O 120.896 0.379 . . . . 0.0 110.872 178.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -67.63 162.06 24.4 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.749 0.82 . . . . 0.0 111.68 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.85 65.95 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.522 1.129 . . . . 0.0 112.546 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -72.73 -37.05 67.88 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.13 0.572 . . . . 0.0 111.638 -171.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.43 -44.69 74.41 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.575 0.75 . . . . 0.0 109.767 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.44 -45.61 66.07 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 118.271 0.487 . . . . 0.0 110.365 170.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.86 76.0 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.617 0.767 . . . . 0.0 109.984 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.7 m -60.59 -47.01 88.07 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 124.005 0.922 . . . . 0.0 110.383 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.47 -35.71 46.27 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -171.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.12 -34.91 79.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -67.35 -50.75 58.6 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.549 0.613 . . . . 0.0 111.174 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.05 -41.63 96.95 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.596 0.635 . . . . 0.0 111.63 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -83.76 -11.94 56.4 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.041 0.536 . . . . 0.0 111.975 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.6 mt -83.79 -34.59 24.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.362 0.983 . . . . 0.0 111.105 162.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -66.06 -66.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.872 1.269 . . . . 0.0 111.078 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -153.53 -40.66 0.1 Allowed 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 -158.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.36 157.78 37.02 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.4 p -146.6 168.7 20.63 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.01 -1.056 . . . . 0.0 109.732 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -103.76 31.43 4.45 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.386 0.674 . . . . 0.0 111.0 -172.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.7 p -26.26 106.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.869 2.468 . . . . 0.0 112.734 -171.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.47 148.85 63.49 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.864 -162.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -61.99 -26.57 78.73 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.278 1.985 . . . . 0.0 112.712 -173.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -60.64 -56.36 22.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.143 170.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 70.4 m -63.65 -36.8 85.02 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 119.046 0.839 . . . . 0.0 111.629 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.63 72.18 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.136 0.88 . . . . 0.0 111.679 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 m -80.25 -46.75 15.72 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.254 1.022 . . . . 0.0 111.258 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -82.7 -26.18 32.28 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.646 0.778 . . . . 0.0 112.2 -170.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.252 1.234 1 C-N-CA 133.324 4.65 . . . . 0.0 110.3 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.581 0 CA-C-O 118.675 -0.679 . . . . 0.0 112.473 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -55.34 100.53 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.513 1.925 . . . . 0.0 112.332 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -128.42 137.62 51.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.826 1.25 . . . . 0.0 109.504 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 99.55 8.87 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.557 0.743 . . . . 0.0 109.697 174.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 71.0 mt -93.51 101.81 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.56 102.66 1.19 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.487 1.915 . . . . 0.0 109.338 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.8 t -110.23 -175.13 2.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.092 1.757 . . . . 0.0 109.75 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.86 153.89 37.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.619 1.168 . . . . 0.0 110.853 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.2 t -73.62 106.55 5.43 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.337 1.855 . . . . 0.0 108.116 169.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.0 t -57.48 -10.07 1.32 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.574 1.95 . . . . 0.0 114.372 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -114.49 -10.91 12.52 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.888 1.275 . . . . 0.0 114.346 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 p -132.61 -0.51 3.53 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.7 1.591 . . . . 0.0 114.487 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t0 52.38 23.96 2.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.0 2.52 . . . . 0.0 113.492 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.75 139.79 16.68 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.55 -1.82 . . . . 0.0 108.55 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.38 140.78 29.7 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 112.067 -162.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 mt -126.05 107.28 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -78.1 92.76 4.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.6 mt -71.5 82.74 0.81 Allowed 'General case' 0 C--N 1.344 0.327 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 m -75.68 95.34 3.39 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.04 168.22 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 124.857 1.263 . . . . 0.0 107.969 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -124.53 97.64 5.39 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 166.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 t -143.92 167.77 21.54 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.704 0.402 . . . . 0.0 111.175 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 53.7 m -87.57 168.77 12.76 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.782 -1.199 . . . . 0.0 110.458 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.36 -48.07 68.86 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.572 1.149 . . . . 0.0 112.906 -172.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.61 -50.26 65.71 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.728 -0.654 . . . . 0.0 109.976 -172.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -57.89 -43.72 86.25 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.28 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.57 -38.63 72.24 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.012 0.823 . . . . 0.0 111.58 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -44.65 64.66 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.691 1.196 . . . . 0.0 111.762 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 m -71.44 -41.73 69.09 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.974 1.309 . . . . 0.0 109.698 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.97 -38.1 64.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.36 -42.77 96.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.141 -1.023 . . . . 0.0 109.821 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -68.7 -35.88 77.74 Favored 'General case' 0 CA--C 1.504 -0.816 0 C-N-CA 118.003 -1.479 . . . . 0.0 111.916 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.8 mt -67.2 -40.55 86.48 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 118.667 -1.213 . . . . 0.0 110.52 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -72.19 -28.82 63.45 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.38 1.072 . . . . 0.0 111.308 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -71.78 -36.59 70.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.846 0.748 . . . . 0.0 111.292 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.8 t -71.3 -69.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.852 1.661 . . . . 0.0 111.936 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -150.98 -29.45 0.19 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 -158.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 166.72 16.47 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.568 0.699 . . . . 0.0 109.148 168.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.2 m -167.16 -178.37 4.1 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.439 1.896 . . . . 0.0 106.984 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.49 176.26 8.87 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.185 0.594 . . . . 0.0 110.127 -171.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.61 138.61 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 125.899 1.68 . . . . 0.0 107.693 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.9 p -80.06 154.11 74.94 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.882 0.473 . . . . 0.0 109.917 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.74 -26.96 60.24 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.54 2.16 . . . . 0.0 112.949 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.27 -61.94 2.06 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.121 0.969 . . . . 0.0 109.503 170.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 95.6 m -64.97 -34.97 79.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 118.822 -0.608 . . . . 0.0 112.277 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.31 -35.48 71.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.21 0.914 . . . . 0.0 111.43 172.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -80.61 -44.06 19.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.172 0.989 . . . . 0.0 111.248 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.405 ' N ' HD21 ' A' ' 55' ' ' ASN . 0.9 OUTLIER -76.52 -22.8 53.94 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.982 0.913 . . . . 0.0 112.506 -176.001 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 C-N-CA 130.257 3.423 . . . . 0.0 111.597 -173.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.257 63.0 tt0 . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 122.343 1.068 . . . . 0.0 110.027 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.24 100.91 0.85 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 126.014 1.725 . . . . 0.0 109.075 170.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -99.08 170.48 8.67 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.258 0.349 . . . . 0.0 110.543 173.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -116.54 123.56 47.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 168.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.9 mt -126.41 103.97 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 125.437 1.495 . . . . 0.0 107.572 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.76 109.44 2.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.924 0.89 . . . . 0.0 109.277 168.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.5 m -105.55 177.42 4.86 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.095 0.958 . . . . 0.0 109.5 167.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -135.92 155.79 36.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.521 0.677 . . . . 0.0 112.253 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.5 t -76.73 111.52 12.33 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.584 1.153 . . . . 0.0 109.098 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.0 t -61.86 -13.28 22.96 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -80.17 -50.5 10.2 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.622 1.556 . . . . 0.0 110.252 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.9 p -116.34 0.45 12.83 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.462 -161.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.8 t0 52.07 29.35 6.25 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.339 2.256 . . . . 0.0 111.653 -173.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -64.75 133.25 37.71 Favored Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -77.22 103.31 7.08 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 128.221 2.608 . . . . 0.0 109.402 -170.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.5 mt -118.61 88.93 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 122.312 1.053 . . . . 0.0 108.651 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.13 99.8 0.71 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.562 1.545 . . . . 0.0 108.896 170.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -83.5 161.93 21.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 171.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.9 t -136.12 126.0 25.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 157.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.6 m -143.77 141.96 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 -172.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -108.89 113.24 25.98 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -172.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.0 t -148.85 152.67 36.88 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.9 m -53.85 142.48 23.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.536 -1.666 . . . . 0.0 107.984 163.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.17 -35.55 17.14 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 125.493 1.517 . . . . 0.0 113.71 -171.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.38 -62.44 1.76 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.204 1.402 . . . . 0.0 110.396 -176.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -71.09 -23.56 62.14 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 122.158 -0.339 . . . . 0.0 111.022 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 tp -65.67 -40.85 92.85 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -49.64 76.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.029 0.932 . . . . 0.0 109.66 171.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.4 m -56.75 -51.38 69.12 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.979 0.809 . . . . 0.0 111.265 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.5 pp -74.74 -33.01 62.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.952 0.796 . . . . 0.0 109.742 -169.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.38 -36.66 77.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -65.76 -39.68 91.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.34 0.656 . . . . 0.0 110.971 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.4 mt -58.42 -49.73 76.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.565 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -67.02 -28.44 68.24 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.88 -35.52 67.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.794 0.725 . . . . 0.0 111.111 173.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -80.27 -71.79 0.44 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.175 1.39 . . . . 0.0 111.673 -173.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.0 m -147.38 -30.16 0.33 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.155 0.982 . . . . 0.0 113.188 -158.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.1 tp -72.21 152.75 42.02 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.9 p -142.09 173.64 11.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.969 0.907 . . . . 0.0 108.972 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -117.42 74.9 0.95 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -172.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -65.14 110.02 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.4 p -57.7 150.35 47.5 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 123.063 0.545 . . . . 0.0 110.968 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.26 -23.79 65.75 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.44 2.093 . . . . 0.0 112.615 -175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -57.14 -55.42 34.99 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.861 0.864 . . . . 0.0 110.626 168.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 61.9 m -68.66 -29.93 68.51 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.78 0.832 . . . . 0.0 112.713 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.78 -43.85 97.71 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.163 0.892 . . . . 0.0 110.846 169.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.4 m -72.06 -45.53 60.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.562 1.145 . . . . 0.0 111.246 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -72.66 -23.52 60.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.023 0.529 . . . . 0.0 111.02 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 127.325 2.25 . . . . 0.0 110.723 176.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.4 105.61 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.404 0.681 . . . . 0.0 109.47 162.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -131.19 132.03 44.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.797 1.639 . . . . 0.0 110.053 -175.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -104.62 95.84 6.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.5 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 mt -97.13 98.14 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 -171.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 tt -62.95 101.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.476 1.11 . . . . 0.0 110.445 177.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.4 m -104.23 -177.59 3.41 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.4 0.28 . . . . 0.0 111.349 176.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.45 155.39 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 O-C-N 120.953 -1.092 . . . . 0.0 111.147 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.3 t -70.94 120.42 16.48 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.879 1.272 . . . . 0.0 108.982 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.0 t -57.42 -25.8 60.15 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.202 1.401 . . . . 0.0 113.402 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -90.29 -48.31 7.22 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.001 0.818 . . . . 0.0 111.176 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.7 p -113.92 0.9 14.55 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.797 0.839 . . . . 0.0 112.815 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.8 t70 58.77 21.11 8.59 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.787 2.035 . . . . 0.0 112.546 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.36 140.4 30.75 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -176.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -65.0 109.07 2.0 Allowed 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 127.155 2.182 . . . . 0.0 109.007 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.7 mm -96.75 151.69 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 162.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -134.59 115.9 14.39 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 120.009 -1.682 . . . . 0.0 108.379 161.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -79.37 85.66 5.16 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.2 m -71.56 74.75 0.79 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.369 0.986 . . . . 0.0 108.971 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.5 m -101.49 178.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 122.406 1.098 . . . . 0.0 109.317 -177.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.406 ' C ' ' HG ' ' A' ' 29' ' ' SER . 2.4 mp0 -129.33 113.11 14.56 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 128.394 2.677 . . . . 0.0 104.434 172.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.406 ' HG ' ' C ' ' A' ' 28' ' ' GLU . 70.7 m -157.77 125.18 5.16 Favored 'General case' 0 N--CA 1.437 -1.087 0 O-C-N 120.184 -1.572 . . . . 0.0 109.979 -169.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -65.12 151.63 45.59 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.034 1.334 . . . . 0.0 110.267 -175.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -44.06 -49.12 8.9 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.316 1.447 . . . . 0.0 114.865 -170.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.33 -36.46 58.25 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 121.29 0.567 . . . . 0.0 110.973 -167.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -47.91 75.61 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.417 1.087 . . . . 0.0 109.599 168.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.12 -39.43 94.01 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 122.0 -0.438 . . . . 0.0 111.297 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -64.0 1.04 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 167.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.2 m -51.92 -44.16 63.73 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.869 0.759 . . . . 0.0 111.005 -170.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.19 -36.22 64.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.431 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.91 -34.09 76.69 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.199 175.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -32.34 66.56 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.626 0.648 . . . . 0.0 110.697 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.39 -49.4 77.07 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.083 0.856 . . . . 0.0 110.559 170.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.46 -42.15 98.33 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.514 0.597 . . . . 0.0 110.845 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 tp -59.85 -39.59 85.7 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.509 1.123 . . . . 0.0 111.401 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.8 t -72.98 -63.65 1.13 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.562 1.145 . . . . 0.0 111.501 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -160.19 -27.09 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -158.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 tp -70.67 156.96 38.81 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.443 1.019 . . . . 0.0 109.026 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -161.92 172.63 15.71 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 125.845 1.658 . . . . 0.0 106.647 170.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -116.04 178.07 4.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.128 0.971 . . . . 0.0 109.214 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.6 131.73 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -69.47 152.12 96.49 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -62.99 -26.31 74.02 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.18 1.92 . . . . 0.0 112.65 -176.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -59.62 -59.27 5.7 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.055 0.542 . . . . 0.0 109.872 169.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.8 m -60.28 -35.17 74.93 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.865 0.757 . . . . 0.0 112.204 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.96 96.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.857 0.753 . . . . 0.0 110.672 175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.2 m -75.24 -38.21 60.7 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.214 1.006 . . . . 0.0 111.555 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.86 -9.22 59.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.305 1.042 . . . . 0.0 111.915 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.414 10.4 pt20 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 128.953 2.901 . . . . 0.0 113.222 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 . . . . . 0 N--CA 1.426 -1.647 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 ttm-85 -63.12 92.95 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 N-CA-C 115.281 1.585 . . . . 0.0 115.281 -166.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.0 m170 -118.98 150.03 40.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.174 -1.376 . . . . 0.0 109.051 -173.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -123.57 83.91 2.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mt -90.24 97.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 tt -70.87 93.04 0.94 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 123.563 0.745 . . . . 0.0 110.016 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.4 t -81.1 171.75 14.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.145 0.978 . . . . 0.0 108.427 167.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.0 m -121.67 156.88 25.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.623 0.725 . . . . 0.0 109.571 164.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.0 t -76.88 108.22 9.77 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.218 1.407 . . . . 0.0 108.151 169.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.28 -4.66 0.88 Allowed 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -172.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -111.34 -16.87 13.27 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 120.354 1.434 . . . . 0.0 114.798 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 26.7 p -126.44 0.73 6.95 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.439 1.472 . . . . 0.0 113.952 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.1 t70 56.1 20.02 4.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.195 2.198 . . . . 0.0 112.864 -169.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.48 140.86 31.32 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 120.939 -1.101 . . . . 0.0 110.4 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 122.55 18.73 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.784 2.034 . . . . 0.0 109.724 -173.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.6 mt -124.06 99.01 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -82.7 92.6 7.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.064 0.546 . . . . 0.0 109.549 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -77.04 89.18 3.57 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -176.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.6 m -67.29 97.88 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.2 127.59 51.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 122.211 1.005 . . . . 0.0 110.204 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.88 92.35 7.77 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.7 p -132.68 142.99 49.34 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 127.313 2.245 . . . . 0.0 108.28 -158.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -83.53 -81.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 120.544 1.52 . . . . 0.0 112.393 -159.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -165.68 -61.42 0.03 OUTLIER 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.23 -40.89 70.8 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.038 1.335 . . . . 0.0 109.058 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -49.05 76.44 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.002 1.321 . . . . 0.0 109.953 171.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.57 -46.68 86.39 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.011 0.524 . . . . 0.0 110.185 178.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.72 -55.39 34.98 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.0 m -58.28 -47.84 82.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.494 -173.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -65.35 -35.15 80.09 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.329 0.513 . . . . 0.0 110.759 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.51 -43.42 98.89 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 175.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -61.71 -47.45 85.2 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.102 0.864 . . . . 0.0 109.413 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.73 -44.04 97.15 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.291 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -74.95 -24.49 58.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.489 0.716 . . . . 0.0 110.887 -175.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.46 -36.69 45.0 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.455 0.702 . . . . 0.0 111.047 169.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 t -69.01 -67.43 0.47 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.798 1.239 . . . . 0.0 111.662 -173.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.46 -41.36 0.09 Allowed 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -158.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 tp -69.68 150.01 47.44 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -143.78 167.23 22.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 124.003 0.921 . . . . 0.0 109.038 166.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -95.3 -30.35 14.0 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -162.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.4 t 61.21 113.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 127.853 2.461 . . . . 0.0 111.916 -175.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.0 p -66.36 153.56 92.44 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 120.949 -1.094 . . . . 0.0 110.343 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.13 -24.57 66.1 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 122.399 2.066 . . . . 0.0 112.704 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -58.76 -53.55 57.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.172 0.589 . . . . 0.0 110.402 170.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.1 m -66.82 -36.32 82.08 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.661 175.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.53 -28.98 67.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.1 1.318 . . . . 0.0 112.029 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.0 m -82.28 -43.97 16.86 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.53 1.132 . . . . 0.0 111.303 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.83 -40.47 22.45 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.553 0.741 . . . . 0.0 112.01 -172.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 . . . . . 0 C--O 1.256 1.397 1 C-N-CA 134.139 4.975 . . . . 0.0 112.07 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.297 0.9 OUTLIER . . . . . 0 N--CA 1.44 -0.929 0 CA-C-O 116.739 -1.6 . . . . 0.0 111.259 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -51.29 103.45 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.936 1.244 . . . . 0.0 111.637 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -125.93 138.18 53.75 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -119.63 82.49 1.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.772 0.829 . . . . 0.0 108.91 -173.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.5 mt -90.35 101.25 12.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 -171.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 24' ' ' GLU . 2.2 tt -74.82 87.07 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.326 1.05 . . . . 0.0 110.068 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.8 t -80.02 -171.5 2.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.178 1.391 . . . . 0.0 108.846 159.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 m -139.67 164.93 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 121.153 -0.967 . . . . 0.0 111.177 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.87 112.91 5.18 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 166.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -58.51 -18.96 33.31 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.917 0.887 . . . . 0.0 113.34 -171.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -109.01 -14.75 14.49 Favored 'General case' 0 C--N 1.345 0.389 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -128.33 2.28 5.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.644 1.565 . . . . 0.0 114.054 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 57.72 20.32 6.32 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.234 1.814 . . . . 0.0 112.989 -174.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.45 150.85 52.09 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 121.082 -1.011 . . . . 0.0 110.633 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.408 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -66.51 112.01 3.88 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.705 2.002 . . . . 0.0 108.833 -172.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.0 mm -121.64 85.61 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 123.369 1.557 . . . . 0.0 108.05 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 13' ' ' LEU . 7.5 pt-20 -66.82 121.24 15.04 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.443 159.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.1 mt -86.39 75.96 9.72 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 161.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.3 m -73.77 94.88 2.31 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 165.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.67 175.55 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.829 1.651 . . . . 0.0 108.45 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -120.47 119.87 34.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 162.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -143.25 169.01 18.43 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.639 1.176 . . . . 0.0 109.491 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 m -95.94 175.46 6.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 159.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.14 79.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.405 0.682 . . . . 0.0 111.958 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.09 -40.05 82.71 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.198 0.999 . . . . 0.0 110.764 -178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -63.51 -47.91 79.74 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.378 1.471 . . . . 0.0 109.404 173.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.83 -46.62 81.57 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.675 0.79 . . . . 0.0 109.962 175.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.0 ttt180 -59.88 -52.25 66.22 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.7 m -56.91 -52.23 65.98 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.241 1.016 . . . . 0.0 111.117 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.93 -31.49 72.69 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -63.16 -44.5 95.29 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 118.323 -0.846 . . . . 0.0 109.354 172.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.32 -46.1 89.51 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.523 1.056 . . . . 0.0 110.311 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -46.87 80.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.291 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -65.73 -26.59 67.81 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.795 0.685 . . . . 0.0 112.563 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -75.67 -33.87 60.43 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.317 1.847 . . . . 0.0 111.168 172.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -75.68 -67.37 0.67 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.112 0.965 . . . . 0.0 111.23 -172.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -157.76 -36.38 0.07 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.851 1.261 . . . . 0.0 112.515 -158.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.21 154.01 40.96 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.8 p -144.3 168.37 20.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.536 1.134 . . . . 0.0 108.189 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -91.5 -57.02 2.9 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 123.328 0.393 . . . . 0.0 110.665 -176.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t 67.85 134.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.714 2.406 . . . . 0.0 110.338 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.8 p -71.44 149.55 93.76 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.686 -1.259 . . . . 0.0 109.164 174.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.12 -25.48 65.67 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.316 2.01 . . . . 0.0 113.087 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -66.61 -37.92 85.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.936 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.3 m -76.29 -27.35 56.6 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 112.024 170.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.66 74.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.957 1.708 . . . . 0.0 110.718 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.2 m -76.63 -62.5 1.61 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.139 0.976 . . . . 0.0 111.219 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -83.9 -23.71 31.1 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -167.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 . . . . . 0 C--O 1.246 0.877 0 C-N-CA 128.402 2.681 . . . . 0.0 113.449 177.822 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 . . . . . 0 CA--C 1.539 0.55 0 CA-C-O 123.156 1.455 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.59 108.04 0.21 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 126.539 1.936 . . . . 0.0 110.804 166.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -125.97 166.37 17.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 125.097 1.359 . . . . 0.0 110.303 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.46 89.27 3.01 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.7 mt -78.98 94.65 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.24 103.31 1.55 Allowed 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 121.221 -0.925 . . . . 0.0 109.255 170.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t -104.71 179.01 4.4 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.897 0.879 . . . . 0.0 108.865 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.1 m -134.25 153.94 36.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-O 121.747 0.784 . . . . 0.0 111.027 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.6 t -73.88 115.13 12.96 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.359 1.464 . . . . 0.0 109.818 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 t -59.7 -13.34 9.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.551 1.54 . . . . 0.0 113.905 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -115.7 -11.24 11.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.7 p -136.09 1.86 2.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.943 1.701 . . . . 0.0 114.855 174.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 55.55 20.79 4.0 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 127.477 2.311 . . . . 0.0 113.5 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.92 140.88 30.8 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 120.823 -1.173 . . . . 0.0 110.265 -177.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.464 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -69.43 123.46 21.29 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.673 1.989 . . . . 0.0 109.391 -175.466 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.5 mp -119.61 106.49 19.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 164.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.464 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 41.2 tt0 -81.38 90.42 6.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.5 mt -70.2 86.42 0.57 Allowed 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.4 m -70.09 101.37 1.81 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.2 m -136.61 139.58 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.091 0.956 . . . . 0.0 108.617 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.5 mp0 -95.58 91.27 6.06 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.23 -2.137 . . . . 0.0 105.23 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.1 p -132.65 120.26 21.51 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 124.57 1.148 . . . . 0.0 109.872 -166.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -57.81 148.13 26.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.72 1.263 . . . . 0.0 109.452 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -50.9 -40.59 57.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.869 0.867 . . . . 0.0 113.042 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.9 -45.32 82.41 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.342 1.057 . . . . 0.0 111.764 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.75 -54.85 41.46 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tt -52.43 -48.63 65.64 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.039 0.936 . . . . 0.0 110.584 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -57.05 -48.09 79.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.679 0.791 . . . . 0.0 109.695 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -56.45 -50.12 72.62 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.604 0.762 . . . . 0.0 110.43 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.46 -43.7 71.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -67.5 -36.29 80.79 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.318 -169.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -62.04 -46.51 88.82 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 123.748 0.819 . . . . 0.0 109.634 173.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.03 -52.43 63.99 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 118.416 -0.802 . . . . 0.0 110.59 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -64.17 -29.23 70.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -70.67 -41.43 72.06 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.087 0.955 . . . . 0.0 111.251 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -70.15 -68.04 0.45 Allowed 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.727 1.611 . . . . 0.0 111.422 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -155.08 -34.19 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -158.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.1 tp -71.0 165.92 22.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.86 0.838 . . . . 0.0 109.154 175.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.5 m -159.38 -175.04 4.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -118.62 169.37 9.87 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.16 0.984 . . . . 0.0 108.712 -176.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.9 p -144.97 132.33 16.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.4 p -70.41 154.45 94.45 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.911 -0.566 . . . . 0.0 109.933 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -63.7 -31.59 69.19 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.243 1.962 . . . . 0.0 112.719 -174.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -56.55 -49.92 73.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.745 0.818 . . . . 0.0 110.397 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 m -68.86 -31.19 69.97 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.167 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.14 71.04 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.093 1.315 . . . . 0.0 111.513 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.99 -16.62 18.65 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -108.84 -31.25 7.76 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.562 1.073 . . . . 0.0 111.964 176.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.27 69.1 mt-30 . . . . . 0 C--O 1.255 1.361 0 C-N-CA 129.787 3.235 . . . . 0.0 115.883 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.21 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 t -150.94 176.55 11.0 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -134.99 110.69 9.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.791 1.237 . . . . 0.0 108.178 -171.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 tpp -153.13 98.67 2.31 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.442 ' H ' ' CD ' ' A' ' 6' ' ' GLU . . . -146.26 23.7 1.31 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.215 1.806 . . . . 0.0 114.238 -164.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.442 ' CD ' ' H ' ' A' ' 5' ' ' ALA . 25.1 mp0 -86.13 156.88 57.28 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 122.795 0.438 . . . . 0.0 110.683 -161.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -65.76 169.82 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.283 1.989 . . . . 0.0 109.955 170.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 55.4 -67.52 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 127.96 2.504 . . . . 0.0 112.686 -164.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -54.05 89.17 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -128.97 133.23 47.72 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.662 1.185 . . . . 0.0 108.748 -168.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.48 94.89 5.57 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.261 1.024 . . . . 0.0 109.327 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.3 mt -96.41 98.66 7.91 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.391 0.2 OUTLIER -84.1 124.33 31.0 Favored 'General case' 0 N--CA 1.439 -0.99 0 O-C-N 120.816 -1.177 . . . . 0.0 111.688 -177.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.1 t -120.5 -154.94 0.6 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.284 2.234 . . . . 0.0 108.055 172.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.427 ' CG1' HH21 ' A' ' 22' ' ' ARG . 13.4 m -137.17 159.97 36.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 O-C-N 120.502 -1.374 . . . . 0.0 111.22 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.2 t -66.02 110.97 3.13 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -56.91 -11.51 1.5 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.617 1.967 . . . . 0.0 114.232 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -121.21 -14.66 8.31 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -175.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -125.66 2.79 7.53 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.08 1.309 . . . . 0.0 113.778 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.3 t70 58.13 15.91 3.55 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.861 2.464 . . . . 0.0 113.678 -177.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.06 146.83 28.35 Favored Glycine 0 C--N 1.342 0.871 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -174.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.427 HH21 ' CG1' ' A' ' 15' ' ' VAL . 1.8 tpp85 -70.92 119.14 14.61 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 124.548 1.139 . . . . 0.0 110.573 -166.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 78.6 mt -109.26 100.11 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 169.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.29 97.18 1.53 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 163.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.69 82.92 0.87 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.0 m -69.97 102.17 1.95 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -118.55 172.94 5.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 C-N-CA 124.676 1.19 . . . . 0.0 108.619 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -120.98 92.91 3.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 165.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -133.31 131.08 39.74 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.789 0.835 . . . . 0.0 109.118 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 m -62.53 162.21 10.73 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.4 62.41 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 122.904 0.482 . . . . 0.0 112.254 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -75.19 -33.98 61.49 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -174.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -67.09 -45.66 76.6 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.37 0.668 . . . . 0.0 109.421 171.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.97 -44.0 86.81 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.567 0.747 . . . . 0.0 110.158 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.79 -53.43 54.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.807 1.243 . . . . 0.0 109.392 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.6 m -59.05 -51.13 71.38 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.788 0.835 . . . . 0.0 109.984 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.16 -28.46 68.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.582 -0.723 . . . . 0.0 110.583 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -50.87 69.38 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 118.826 0.739 . . . . 0.0 109.326 170.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -62.54 -41.05 98.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -175.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.91 -49.13 77.42 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.172 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.36 -34.07 77.13 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.352 0.524 . . . . 0.0 111.635 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.0 tt -66.61 -38.67 87.45 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.191 0.996 . . . . 0.0 110.816 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.8 t -70.88 -67.57 0.5 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.331 1.452 . . . . 0.0 111.452 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -153.89 -36.63 0.1 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -158.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 tp -66.12 148.0 52.48 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.524 0.678 . . . . 0.0 109.604 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.8 m -160.5 168.14 25.72 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -121.02 174.02 6.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.853 1.661 . . . . 0.0 107.881 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.0 m -133.22 148.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 C-N-CA 126.588 1.955 . . . . 0.0 108.164 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.6 p -75.28 157.04 85.32 Favored Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -64.2 -27.0 64.45 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.188 1.925 . . . . 0.0 113.128 -174.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 43.0 t90 -58.5 -59.88 4.68 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.008 0.523 . . . . 0.0 109.767 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.2 m -58.77 -42.86 89.96 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.799 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.44 68.43 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.137 0.881 . . . . 0.0 112.409 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.1 m -79.68 -35.98 38.36 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.806 0.843 . . . . 0.0 111.241 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.77 -49.19 10.7 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 118.591 -0.719 . . . . 0.0 111.418 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 . . . . . 0 C--O 1.25 1.109 1 C-N-CA 133.966 4.907 . . . . 0.0 108.961 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.119 0 N-CA-C 107.563 -2.215 . . . . 0.0 107.563 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 t -65.23 161.27 19.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 118.375 -1.33 . . . . 0.0 107.531 137.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -144.28 97.8 3.1 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 125.167 1.387 . . . . 0.0 107.792 -175.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.8 ttp -149.9 34.93 0.68 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.136 1.374 . . . . 0.0 109.251 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -133.71 26.65 4.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.571 2.348 . . . . 0.0 110.726 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -134.81 153.96 79.07 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 126.855 2.062 . . . . 0.0 108.003 -172.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.89 51.28 3.03 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.247 3.298 . . . . 0.0 110.751 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -136.34 -76.26 0.43 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.926 1.69 . . . . 0.0 108.742 -169.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.67 101.31 0.07 Allowed 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.229 1.412 . . . . 0.0 111.532 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -126.38 152.18 46.65 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.333 1.453 . . . . 0.0 109.125 -173.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -125.51 96.35 4.77 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.0 mt -97.31 97.76 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -171.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.88 102.34 0.77 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 p -98.9 -172.27 2.26 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 162.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -130.7 151.69 36.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 121.779 0.8 . . . . 0.0 110.565 174.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -70.27 106.38 3.32 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.283 1.833 . . . . 0.0 108.335 162.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -59.9 -8.73 2.38 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 114.141 -174.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -114.1 -14.74 12.34 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.9 p -122.09 -0.82 9.38 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.005 1.275 . . . . 0.0 113.307 170.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.8 t0 50.97 23.33 1.44 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.514 2.325 . . . . 0.0 112.782 -169.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.63 137.46 18.16 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -76.42 139.12 40.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.231 -0.984 . . . . 0.0 109.807 -170.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.0 mt -130.42 98.62 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -72.8 87.89 1.3 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.502 1.521 . . . . 0.0 109.552 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.0 mt -70.22 86.68 0.58 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.845 0.858 . . . . 0.0 108.79 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.3 m -72.2 105.25 3.93 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 169.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.6 m -124.28 173.49 10.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 125.365 1.466 . . . . 0.0 109.204 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -125.11 99.76 6.25 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -157.95 130.26 7.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.693 -1.255 . . . . 0.0 108.634 -164.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 m -65.67 165.77 11.93 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -158.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.0 46.89 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.193 1.397 . . . . 0.0 113.635 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.14 -50.84 62.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -54.56 -44.79 73.23 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.874 0.87 . . . . 0.0 110.543 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.48 -48.68 76.61 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.259 0.624 . . . . 0.0 110.662 174.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.463 ' HE ' ' NE2' ' A' ' 39' ' ' GLN . 0.3 OUTLIER -62.15 -53.93 48.35 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 179.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 m -58.97 -49.87 76.24 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 124.162 0.985 . . . . 0.0 110.467 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.91 -32.72 74.56 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.32 0.964 . . . . 0.0 111.493 176.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -57.86 -45.84 85.7 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 173.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.463 ' NE2' ' HE ' ' A' ' 35' ' ' ARG . 14.7 mm-40 -60.19 -42.05 94.21 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 118.909 0.777 . . . . 0.0 110.364 178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.9 mt -59.48 -49.96 75.75 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.109 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -65.97 -33.36 75.64 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.174 0.443 . . . . 0.0 111.61 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.26 -38.59 90.79 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.829 0.74 . . . . 0.0 111.391 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.413 ' C ' ' HG1' ' A' ' 44' ' ' THR . 14.6 t -74.31 -58.94 2.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.63 1.172 . . . . 0.0 111.168 -174.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.413 ' HG1' ' C ' ' A' ' 43' ' ' SER . 54.1 m -163.37 -23.24 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.45 142.97 58.24 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 120.074 1.307 . . . . 0.0 110.056 -173.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.3 m -155.79 166.72 32.64 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 165.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -119.77 -172.88 2.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -165.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.52 126.86 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.4 p -68.73 150.32 97.67 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.93 -28.66 66.87 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.143 1.895 . . . . 0.0 113.523 -169.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -61.44 -49.82 75.29 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.808 0.443 . . . . 0.0 110.792 171.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.6 m -68.15 -32.78 73.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.842 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.01 -32.08 73.63 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 120.012 1.278 . . . . 0.0 111.437 173.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.8 m -76.48 -49.74 15.81 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.428 1.091 . . . . 0.0 110.928 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -85.69 -16.72 38.14 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.767 0.827 . . . . 0.0 112.544 -173.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 131.038 3.735 . . . . 0.0 114.956 -177.985 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.277 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.5 t 59.48 14.25 3.74 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -135.44 76.78 1.64 Allowed 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 175.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.7 ptm -174.4 175.45 2.59 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 127.759 2.424 . . . . 0.0 106.766 -166.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.87 24.15 13.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.522 1.529 . . . . 0.0 114.223 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -78.5 161.31 70.23 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.237 -167.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -64.1 169.18 11.01 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.053 1.836 . . . . 0.0 110.28 165.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER 64.64 -73.56 0.05 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.184 1.794 . . . . 0.0 111.22 -170.545 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -53.3 92.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.478 2.311 . . . . 0.0 112.586 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -126.47 160.92 29.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.138 0.975 . . . . 0.0 110.167 -175.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -133.45 98.09 4.13 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.275 -0.89 . . . . 0.0 110.254 -168.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.2 mm -86.95 100.22 9.51 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.83 86.75 0.13 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.108 0.963 . . . . 0.0 109.68 173.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.4 t -89.26 176.73 6.83 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.332 1.453 . . . . 0.0 110.018 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -123.75 158.48 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.322 1.049 . . . . 0.0 110.318 163.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -73.99 115.16 13.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.637 1.975 . . . . 0.0 109.351 169.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.5 t -55.95 -24.44 38.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.066 1.746 . . . . 0.0 113.977 -173.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.44 -41.87 9.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.88 1.218 . . . . 0.0 112.723 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -110.93 -3.64 15.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.7 t0 49.8 38.53 15.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.691 1.996 . . . . 0.0 112.054 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.2 144.86 17.37 Favored Glycine 0 C--N 1.341 0.829 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 170.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.5 149.62 28.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.909 -165.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.94 108.46 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -80.31 91.9 5.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.791 0.836 . . . . 0.0 108.762 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -74.81 87.16 2.24 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -176.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -71.45 95.68 1.4 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 171.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -104.62 172.57 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.383 1.473 . . . . 0.0 109.503 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -123.57 107.47 11.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.217 -1.771 . . . . 0.0 106.217 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.3 t -151.17 169.19 22.48 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.998 0.519 . . . . 0.0 109.808 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.6 m -82.34 170.28 15.52 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.555 -1.341 . . . . 0.0 110.643 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.03 74.42 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.186 0.594 . . . . 0.0 111.285 -174.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' A' ' 32' ' ' GLU . 1.7 mp0 -62.3 -52.73 62.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.76 2.024 . . . . 0.0 109.918 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.88 -46.74 77.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.486 1.114 . . . . 0.0 109.818 177.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.96 -47.19 68.32 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.119 0.418 . . . . 0.0 111.065 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -64.72 -49.65 70.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.4 m -58.69 -50.12 75.04 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.445 0.298 . . . . 0.0 110.365 -176.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.89 -31.94 72.87 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.875 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.23 -41.97 89.92 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 119.611 1.096 . . . . 0.0 108.724 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -63.67 -43.6 96.22 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-N 119.264 0.938 . . . . 0.0 110.313 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.42 -42.7 99.15 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.261 0.482 . . . . 0.0 112.002 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -73.89 -30.82 62.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.788 0.435 . . . . 0.0 111.231 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.3 mt -69.44 -35.61 75.85 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.923 0.783 . . . . 0.0 111.131 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.3 t -67.58 -68.9 0.35 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.461 1.505 . . . . 0.0 110.935 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -36.65 0.1 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -158.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.14 153.0 43.67 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.481 0.658 . . . . 0.0 109.76 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.5 m -165.79 167.87 16.54 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 126.017 1.727 . . . . 0.0 107.126 170.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -115.97 -179.72 3.74 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.214 1.405 . . . . 0.0 108.854 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -134.48 132.66 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 126.766 2.027 . . . . 0.0 105.856 -178.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.1 p -70.14 151.52 95.96 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -62.03 -30.95 83.64 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.929 1.752 . . . . 0.0 112.125 -175.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -56.89 -48.68 77.63 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.287 0.494 . . . . 0.0 111.066 171.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.1 m -69.69 -28.32 65.74 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.278 -0.867 . . . . 0.0 112.413 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.65 81.59 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.378 0.99 . . . . 0.0 110.213 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.8 m -65.55 -47.94 74.13 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.868 0.867 . . . . 0.0 112.006 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.62 -24.0 59.97 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.276 0.489 . . . . 0.0 111.669 -176.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 127.596 2.358 . . . . 0.0 112.621 170.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.107 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 t 57.2 -169.67 0.1 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.895 0.878 . . . . 0.0 111.419 -165.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -148.56 -176.87 5.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 128.72 2.808 . . . . 0.0 107.826 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 39.1 tpp -132.14 155.44 48.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.653 1.181 . . . . 0.0 108.574 173.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.32 69.2 10.7 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.592 1.557 . . . . 0.0 109.14 171.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.503 ' CD ' HH21 ' A' ' 9' ' ' ARG . 14.9 mt-10 -72.94 138.87 79.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 118.849 -0.596 . . . . 0.0 110.682 -168.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -79.11 37.9 0.69 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.159 3.906 . . . . 0.0 111.468 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -140.39 -72.33 0.36 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.831 2.052 . . . . 0.0 107.576 -176.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.503 HH21 ' CD ' ' A' ' 6' ' ' GLU . 26.3 ttm-85 -64.59 101.68 0.48 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.656 1.582 . . . . 0.0 112.73 -172.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -135.48 109.98 8.52 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.152 -1.386 . . . . 0.0 109.989 -159.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -87.11 110.89 20.42 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.91 1.284 . . . . 0.0 108.837 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.0 mt -112.08 98.47 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.87 110.72 2.97 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.218 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.9 t -109.65 -179.21 3.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.407 0.683 . . . . 0.0 109.98 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.3 m -136.95 153.29 29.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 122.051 0.929 . . . . 0.0 112.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 45.4 t -65.38 119.37 10.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.675 163.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.4 t -56.52 -18.67 12.36 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.29 1.436 . . . . 0.0 114.657 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' HE3' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -125.28 -16.92 5.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -164.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.9 p -121.71 0.63 9.87 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.816 0.846 . . . . 0.0 113.072 169.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.59 19.85 4.52 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.302 1.841 . . . . 0.0 112.647 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.0 131.46 36.41 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -71.88 114.67 10.22 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 127.286 2.234 . . . . 0.0 109.621 -169.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.1 mm -110.15 134.57 51.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -105.91 93.28 4.55 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 174.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -79.68 82.49 5.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . 0.339 5.7 t -73.62 103.52 4.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 117.514 -1.674 . . . . 0.0 108.674 161.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.73 172.02 1.19 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 158.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.61 93.71 3.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 160.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.2 t -158.05 171.73 19.71 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.67 0.388 . . . . 0.0 111.256 -167.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.1 t -68.47 166.7 16.32 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.852 0.834 . . . . 0.0 111.678 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.72 72.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.951 1.3 . . . . 0.0 111.369 167.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -68.14 -48.79 64.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.025 0.93 . . . . 0.0 110.057 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -67.94 -46.27 71.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.802 1.241 . . . . 0.0 109.865 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tt -48.91 -51.61 29.09 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 118.348 0.522 . . . . 0.0 110.271 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -59.93 -55.86 28.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 m -53.17 -53.04 56.34 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.193 0.997 . . . . 0.0 110.063 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -34.85 79.21 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.058 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.47 -46.86 88.53 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 117.185 -1.388 . . . . 0.0 109.476 170.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -46.36 82.35 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 121.128 1.785 . . . . 0.0 109.862 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.45 -43.63 69.47 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -67.44 -23.36 65.51 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.35 -34.18 48.58 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.262 1.825 . . . . 0.0 110.844 171.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.3 t -66.75 -67.54 0.44 Allowed 'General case' 0 C--N 1.339 0.152 0 C-N-CA 124.302 1.041 . . . . 0.0 110.287 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -44.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.775 0.83 . . . . 0.0 112.384 -158.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.01 139.09 55.25 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -144.96 161.98 38.03 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -172.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -118.31 68.75 0.78 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 117.963 0.347 . . . . 0.0 110.919 -158.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 35.7 m -62.33 113.19 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-O 121.64 0.733 . . . . 0.0 109.671 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.1 p -57.97 152.96 36.24 Favored Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 124.21 1.004 . . . . 0.0 110.317 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -63.72 -25.87 68.53 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.303 2.002 . . . . 0.0 113.096 -171.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.3 t90 -60.79 -53.32 58.81 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.292 0.497 . . . . 0.0 109.848 169.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.414 ' SG ' ' HE3' ' A' ' 18' ' ' LYS . 10.0 m -62.62 -36.74 83.76 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.919 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.5 88.61 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.597 0.635 . . . . 0.0 111.296 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 m -74.06 -42.06 60.8 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.306 1.042 . . . . 0.0 111.402 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -86.67 -19.86 28.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.436 0.694 . . . . 0.0 112.336 -172.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.549 2.34 . . . . 0.0 111.156 -173.095 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.203 0 N-CA-C 110.146 -1.181 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.8 t -138.55 20.54 2.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.791 0.836 . . . . 0.0 112.048 -176.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -136.89 172.92 12.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 167.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.9 ttm -66.05 161.34 21.85 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.329 1.452 . . . . 0.0 110.904 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.29 92.84 9.31 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 159.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -83.41 143.79 45.24 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.346 -159.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -78.82 46.5 2.19 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.144 3.896 . . . . 0.0 111.186 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -152.49 -66.74 0.16 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -55.0 93.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 127.522 2.329 . . . . 0.0 111.478 172.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.6 m170 -125.29 143.97 50.7 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.888 1.275 . . . . 0.0 110.451 -168.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.57 82.19 1.68 Allowed 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.118 0.567 . . . . 0.0 109.711 -176.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.82 100.91 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -72.56 100.06 2.67 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 120.928 -1.107 . . . . 0.0 109.778 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.45 -173.94 4.77 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 160.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.45 159.41 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.641 1.176 . . . . 0.0 110.01 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.27 113.28 9.14 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.769 2.028 . . . . 0.0 108.558 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.4 t -56.9 -18.65 14.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.17 1.788 . . . . 0.0 113.458 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.32 -16.19 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.0 p -129.9 -0.8 4.75 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.749 1.613 . . . . 0.0 114.475 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 55.1 24.06 5.8 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.556 1.943 . . . . 0.0 113.217 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.56 146.37 28.61 Favored Glycine 0 C--N 1.34 0.78 0 N-CA-C 108.714 -1.754 . . . . 0.0 108.714 175.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.79 141.12 39.42 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.613 -166.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mm -121.93 94.09 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -74.25 95.46 2.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.321 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.94 74.06 5.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.3 m -75.39 96.65 3.46 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 167.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.92 157.48 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 C-N-CA 126.143 1.777 . . . . 0.0 108.589 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -104.82 102.59 12.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 -178.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -151.97 156.73 40.61 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 118.057 0.39 . . . . 0.0 110.283 173.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 163.33 21.72 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.234 0.614 . . . . 0.0 111.928 -174.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.61 -34.89 74.91 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.643 0.777 . . . . 0.0 111.329 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.65 -48.92 78.65 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.323 1.849 . . . . 0.0 110.547 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -69.18 -46.99 66.13 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.949 0.9 . . . . 0.0 109.857 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -50.12 -46.14 53.51 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.285 0.634 . . . . 0.0 110.881 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -66.22 -51.79 54.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.8 0.84 . . . . 0.0 109.416 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.6 m -58.05 -51.99 67.39 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.997 0.919 . . . . 0.0 110.078 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.67 -31.44 72.66 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.138 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.39 -51.68 61.78 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.296 0.953 . . . . 0.0 108.871 170.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -59.65 -43.77 93.79 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.31 -47.2 86.28 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.164 0.438 . . . . 0.0 112.053 177.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -71.86 -25.74 62.07 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.034 0.534 . . . . 0.0 112.315 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.97 -43.26 75.33 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.389 0.995 . . . . 0.0 110.561 166.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.433 ' C ' ' HG1' ' A' ' 44' ' ' THR . 10.7 t -66.85 -54.89 17.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.747 1.219 . . . . 0.0 111.22 -172.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.433 ' HG1' ' C ' ' A' ' 43' ' ' SER . 83.2 m -160.25 -27.18 0.06 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 156.78 38.14 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 120.027 1.285 . . . . 0.0 110.685 -171.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.1 m -164.96 171.24 14.26 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.744 1.617 . . . . 0.0 108.35 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -128.38 -179.95 5.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.738 1.215 . . . . 0.0 109.425 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.3 p -147.07 136.83 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.613 1.565 . . . . 0.0 107.146 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.6 p -72.78 154.58 91.17 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.147 -0.454 . . . . 0.0 109.947 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.9 -27.54 58.78 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.34 2.027 . . . . 0.0 112.819 -177.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -58.25 -57.62 12.07 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.063 0.545 . . . . 0.0 109.54 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 m -59.76 -39.5 85.04 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.633 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.537 1.062 . . . . 0.0 111.4 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -76.82 -31.83 57.19 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.455 1.102 . . . . 0.0 111.782 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.98 -6.71 41.75 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.272 1.029 . . . . 0.0 112.705 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.322 14.8 pt20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 129.581 3.152 . . . . 0.0 113.856 -171.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.281 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 58.6 13.89 2.81 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -87.77 153.95 20.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.013 0.925 . . . . 0.0 109.121 172.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 21.7 ttt -147.79 148.93 31.46 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 167.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 121.92 28.21 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 1 C-N-CA 131.937 4.095 . . . . 0.0 111.317 -170.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.68 143.08 50.09 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 123.672 0.789 . . . . 0.0 110.838 -158.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.8 103.6 1.19 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.43 2.753 . . . . 0.0 111.439 -163.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 42.64 58.25 3.2 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.644 1.978 . . . . 0.0 113.483 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -66.12 88.48 0.12 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 110.743 -2.935 . . . . 0.0 108.246 167.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.8 m170 -105.26 173.61 6.23 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.564 1.946 . . . . 0.0 110.683 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.22 93.72 3.64 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 125.345 1.458 . . . . 0.0 107.77 175.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 mt -95.09 100.31 10.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -173.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.8 tt -66.69 112.06 4.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.763 0.825 . . . . 0.0 109.453 175.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 p -108.54 -169.91 1.58 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.125 0.57 . . . . 0.0 110.35 160.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -125.08 165.75 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 122.94 0.496 . . . . 0.0 109.85 165.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.5 t -68.16 124.19 22.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.123 1.369 . . . . 0.0 107.653 160.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.87 -7.05 6.98 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -172.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -137.72 -8.68 1.64 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.6 p -128.75 1.58 5.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.883 1.273 . . . . 0.0 110.469 167.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.73 29.55 9.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.301 2.64 . . . . 0.0 112.49 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.49 141.95 25.32 Favored Glycine 0 C--N 1.339 0.701 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -71.51 120.7 17.46 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 126.766 2.026 . . . . 0.0 110.586 -170.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.53 106.98 18.58 Favored 'Isoleucine or valine' 0 C--N 1.346 0.428 0 CA-C-N 119.928 1.24 . . . . 0.0 108.175 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -79.86 92.46 5.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.832 0.853 . . . . 0.0 109.362 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.4 mt -69.45 90.18 0.52 Allowed 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.1 m -74.88 100.37 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.72 154.2 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 124.421 1.089 . . . . 0.0 109.325 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -113.8 110.11 19.62 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.2 m -155.15 112.6 3.35 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -160.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.4 m -71.13 156.48 39.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.978 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.96 -38.48 62.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -166.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.95 -56.2 9.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.722 1.209 . . . . 0.0 110.664 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -56.97 -38.04 72.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.355 1.862 . . . . 0.0 111.402 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.22 -42.95 96.37 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.381 1.472 . . . . 0.0 109.174 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.92 -42.51 98.25 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.314 0.646 . . . . 0.0 110.367 173.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.6 m -60.96 -54.47 44.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.757 0.708 . . . . 0.0 110.196 175.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.42 -29.64 68.35 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.989 0.813 . . . . 0.0 111.891 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -55.74 -51.4 67.49 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 125.72 1.608 . . . . 0.0 108.183 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -70.63 -33.38 70.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.013 0.525 . . . . 0.0 111.102 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.13 -50.48 71.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.53 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -62.94 -34.63 77.88 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.801 0.728 . . . . 0.0 111.446 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 tt -68.62 -37.78 80.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 0.0 110.711 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 t -70.83 -69.34 0.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.575 1.55 . . . . 0.0 111.796 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -154.9 -32.08 0.1 Allowed 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -158.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.7 tp -64.09 129.12 38.73 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.355 0.662 . . . . 0.0 109.531 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -133.87 166.5 22.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 168.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -122.89 167.45 13.54 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.271 1.428 . . . . 0.0 107.961 -174.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.2 t -140.13 132.67 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -174.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.8 p -69.31 153.43 95.9 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.6 -28.93 69.87 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.096 1.864 . . . . 0.0 113.086 -172.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -59.72 -60.31 4.04 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.521 0.601 . . . . 0.0 109.71 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.5 m -54.96 -43.8 73.8 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.902 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.57 74.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.812 0.733 . . . . 0.0 111.997 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.37 -25.15 39.32 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.345 1.058 . . . . 0.0 112.007 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -104.75 -12.27 16.41 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.614 0.765 . . . . 0.0 112.841 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 116.925 -1.512 . . . . 0.0 112.869 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.272 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t 54.2 37.48 27.29 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.074 0.95 . . . . 0.0 112.583 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -71.26 77.12 0.72 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.762 1.225 . . . . 0.0 110.195 -178.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 46.6 tpp -139.43 114.11 9.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.319 1.047 . . . . 0.0 109.599 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -148.32 140.24 23.91 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 159.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -131.32 156.58 79.93 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.613 0.765 . . . . 0.0 109.105 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -70.43 164.16 36.21 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 N-CA-C 107.567 -1.743 . . . . 0.0 107.567 158.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 58.11 -61.45 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.912 0 C-N-CA 128.317 2.647 . . . . 0.0 112.89 -172.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 110.16 0.7 Allowed 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 121.227 1.83 . . . . 0.0 110.739 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.44 164.8 28.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.524 -1.216 . . . . 0.0 108.721 -176.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.16 117.11 17.07 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -114.79 100.75 11.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.9 tp -72.05 86.24 1.03 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.609 1.964 . . . . 0.0 110.152 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -90.12 -171.66 3.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.458 0.703 . . . . 0.0 109.422 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.93 154.2 39.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 123.181 0.592 . . . . 0.0 110.526 170.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.86 106.47 2.3 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.717 1.207 . . . . 0.0 107.792 162.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.19 -3.18 0.79 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -172.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.65 -16.94 11.23 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 30.5 p -120.05 2.41 10.95 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.117 1.326 . . . . 0.0 112.688 170.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.2 t0 54.21 21.35 3.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.436 2.294 . . . . 0.0 112.578 -171.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.42 129.15 16.73 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -55.32 113.1 1.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 129.254 3.022 . . . . 0.0 108.681 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.251 0.6 OUTLIER -126.55 106.49 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 122.679 1.228 . . . . 0.0 109.327 -172.387 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -87.5 94.26 9.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.254 1.021 . . . . 0.0 109.097 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.65 87.04 1.65 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.9 m -71.79 101.79 2.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 170.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.9 m -107.33 170.41 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.046 1.338 . . . . 0.0 108.463 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -134.25 83.7 2.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 168.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.7 t -154.96 156.7 36.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.712 0.805 . . . . 0.0 109.498 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -72.38 166.28 22.85 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.717 0.807 . . . . 0.0 112.037 -172.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.07 -39.92 63.66 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.077 1.351 . . . . 0.0 113.708 -172.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.43 -42.08 88.22 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.93 0.892 . . . . 0.0 111.369 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -74.07 -41.45 61.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.749 0.82 . . . . 0.0 110.124 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.18 -50.48 49.16 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.287 0.635 . . . . 0.0 110.46 167.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.0 ttt-85 -64.63 -41.95 95.82 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 124.418 1.087 . . . . 0.0 110.628 -177.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 m -63.08 -53.81 47.76 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.817 0.447 . . . . 0.0 110.66 176.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.63 -30.85 69.66 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.144 0.577 . . . . 0.0 110.844 -174.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.13 -59.79 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.262 1.425 . . . . 0.0 108.098 164.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -59.94 -35.72 75.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 117.083 -1.437 . . . . 0.0 111.705 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -46.99 68.63 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.278 1.399 . . . . 0.0 113.903 167.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -67.1 -1.53 4.38 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -114.88 -27.91 7.24 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 126.356 1.862 . . . . 0.0 108.478 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.3 p -77.05 -52.31 9.54 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.257 0.551 . . . . 0.0 111.175 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -157.11 -39.93 0.07 Allowed 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.845 1.258 . . . . 0.0 113.007 -158.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.62 163.17 23.84 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.266 0.555 . . . . 0.0 110.198 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -144.69 170.45 16.07 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 168.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -91.1 -30.18 16.88 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.064 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.4 t 57.48 104.72 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 127.263 2.225 . . . . 0.0 111.942 -175.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.03 150.0 31.91 Favored Pre-proline 0 CA--C 1.537 0.472 0 O-C-N 121.352 -0.842 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.43 -25.72 63.27 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.27 1.98 . . . . 0.0 113.053 -172.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.99 -49.79 76.28 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 169.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 41.7 m -67.6 -34.06 76.25 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.828 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.48 67.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.998 1.272 . . . . 0.0 111.814 174.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -86.08 -52.56 5.61 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.881 1.272 . . . . 0.0 111.043 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -83.6 -18.4 38.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.373 1.069 . . . . 0.0 112.526 -171.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 . . . . . 0 C--O 1.248 0.991 0 C-N-CA 129.752 3.221 . . . . 0.0 113.606 171.646 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.993 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.9 t -165.55 -141.21 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.117 2.567 . . . . 0.0 104.933 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -62.46 -0.12 0.55 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.993 1.317 . . . . 0.0 113.394 164.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 50.1 ttm -132.16 145.36 51.31 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.285 2.234 . . . . 0.0 106.095 165.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -128.88 163.16 25.85 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.434 1.094 . . . . 0.0 108.857 170.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -126.37 152.42 73.94 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.874 1.67 . . . . 0.0 110.379 -166.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -82.08 50.46 3.46 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.909 3.073 . . . . 0.0 110.888 -170.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -148.58 -69.78 0.22 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.522 -0.736 . . . . 0.0 109.856 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -52.74 100.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.657 1.583 . . . . 0.0 111.177 173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -130.13 153.43 48.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.878 1.271 . . . . 0.0 109.546 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -121.88 118.05 27.99 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.978 0.911 . . . . 0.0 108.653 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.5 mt -117.73 101.12 11.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.38 105.38 3.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.314 -0.867 . . . . 0.0 109.323 172.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.0 t -102.52 -179.76 4.07 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.406 1.082 . . . . 0.0 108.387 169.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -131.5 156.46 42.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.828 0.823 . . . . 0.0 109.292 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.31 99.71 2.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 162.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -58.78 -2.05 0.2 Allowed 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.194 1.554 . . . . 0.0 115.194 -173.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -114.69 -14.3 12.03 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.049 1.34 . . . . 0.0 114.449 177.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.4 p -126.08 1.32 7.22 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.565 1.529 . . . . 0.0 113.688 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.2 t0 52.4 25.57 3.59 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.446 2.698 . . . . 0.0 113.668 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.75 137.78 26.21 Favored Glycine 0 C--N 1.34 0.759 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.479 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -70.76 124.01 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 126.528 1.931 . . . . 0.0 109.201 -176.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.44 97.36 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.479 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 40.3 tt0 -79.26 95.43 5.66 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.08 80.61 2.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -177.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -70.16 100.79 1.72 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 164.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.3 m -113.96 173.59 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 125.057 1.343 . . . . 0.0 108.977 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -124.35 104.44 8.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 162.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.6 t -154.43 155.5 35.08 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.013 0.824 . . . . 0.0 111.136 175.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.0 m -70.24 160.66 31.76 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.773 0.829 . . . . 0.0 111.626 -176.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.57 -42.36 67.49 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.307 1.043 . . . . 0.0 113.008 -173.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -70.53 -41.94 71.88 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.791 0.437 . . . . 0.0 111.12 -171.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -64.43 -47.46 79.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.843 0.857 . . . . 0.0 109.609 171.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tt -54.71 -40.4 69.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.89 -0.506 . . . . 0.0 111.504 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -70.22 -40.8 74.31 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 121.133 -0.979 . . . . 0.0 111.471 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.9 m -65.73 -47.95 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.567 0.747 . . . . 0.0 110.327 177.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.03 -34.48 59.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -171.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.23 -47.92 80.41 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 118.127 -0.94 . . . . 0.0 108.933 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.09 -33.4 75.4 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.2 -1.4 . . . . 0.0 112.098 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.9 -42.93 89.6 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 118.497 -1.281 . . . . 0.0 110.03 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -69.42 -27.28 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.985 0.914 . . . . 0.0 112.295 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.29 -39.26 65.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.474 0.71 . . . . 0.0 110.983 171.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.7 t -71.73 -69.11 0.41 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.992 1.717 . . . . 0.0 111.943 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.85 -35.63 0.11 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -158.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.16 165.54 23.38 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -146.49 172.75 13.07 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 125.311 1.444 . . . . 0.0 107.722 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -79.53 -50.35 10.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.911 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t 66.19 125.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.589 2.356 . . . . 0.0 111.269 -172.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.9 p -71.49 152.72 93.92 Favored Pre-proline 0 CA--C 1.538 0.506 0 O-C-N 120.934 -1.104 . . . . 0.0 109.961 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.76 -25.48 60.91 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.228 1.952 . . . . 0.0 112.94 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.94 -56.39 22.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.289 0.495 . . . . 0.0 109.733 170.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.8 m -63.57 -35.59 80.99 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.471 0.578 . . . . 0.0 111.773 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.65 71.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.569 1.077 . . . . 0.0 111.545 174.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.6 m -80.56 -42.65 21.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.281 1.032 . . . . 0.0 111.389 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -85.55 -18.5 33.24 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.662 0.785 . . . . 0.0 112.573 -173.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 130.653 3.581 . . . . 0.0 110.779 -173.449 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -71.11 -57.13 4.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 118.038 0.919 . . . . 0.0 109.747 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -73.12 81.19 1.27 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 173.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.4 102.85 3.89 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.668 0.787 . . . . 0.0 109.617 -173.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.04 131.35 36.24 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 159.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -133.1 161.27 64.77 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 125.668 1.587 . . . . 0.0 106.768 170.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -64.62 168.23 13.62 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.229 1.952 . . . . 0.0 110.031 169.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.3 mm-40 54.66 -64.78 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 128.834 2.854 . . . . 0.0 113.235 -167.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -61.04 86.0 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 129.075 2.95 . . . . 0.0 111.774 -172.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -122.21 152.45 39.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.178 1.391 . . . . 0.0 109.196 -171.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.74 101.79 6.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.5 mt -107.82 102.13 13.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -74.37 103.19 4.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.239 -0.913 . . . . 0.0 109.933 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.3 t -96.17 -177.45 3.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.226 1.41 . . . . 0.0 108.562 168.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.16 158.74 42.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.915 0.864 . . . . 0.0 110.486 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.1 t -74.56 98.95 3.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 164.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 29.3 t -57.37 -15.4 6.39 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -172.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -95.54 -15.36 22.91 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 117.55 -1.214 . . . . 0.0 114.051 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -129.4 1.05 5.08 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 120.588 1.54 . . . . 0.0 114.134 175.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t0 52.43 22.56 2.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 128.349 2.659 . . . . 0.0 113.423 -171.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.45 143.28 38.64 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.92 118.58 14.95 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.071 2.148 . . . . 0.0 110.21 -173.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.0 mt -124.69 90.82 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-O 122.143 0.973 . . . . 0.0 108.78 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.33 100.8 0.86 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.575 1.15 . . . . 0.0 109.71 170.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 mt -79.82 73.47 6.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -69.09 102.16 1.58 Allowed 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.5 m -124.08 170.92 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 125.611 1.564 . . . . 0.0 108.908 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -120.91 99.49 6.54 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 t -150.89 156.24 40.81 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-O 120.896 0.379 . . . . 0.0 110.872 178.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -67.63 162.06 24.4 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.749 0.82 . . . . 0.0 111.68 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.85 65.95 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.522 1.129 . . . . 0.0 112.546 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -72.73 -37.05 67.88 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.13 0.572 . . . . 0.0 111.638 -171.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.43 -44.69 74.41 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.575 0.75 . . . . 0.0 109.767 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.44 -45.61 66.07 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 118.271 0.487 . . . . 0.0 110.365 170.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.86 76.0 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.617 0.767 . . . . 0.0 109.984 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.7 m -60.59 -47.01 88.07 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 124.005 0.922 . . . . 0.0 110.383 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.47 -35.71 46.27 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -171.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.12 -34.91 79.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -67.35 -50.75 58.6 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.549 0.613 . . . . 0.0 111.174 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.05 -41.63 96.95 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.596 0.635 . . . . 0.0 111.63 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -83.76 -11.94 56.4 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.041 0.536 . . . . 0.0 111.975 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.6 mt -83.79 -34.59 24.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.362 0.983 . . . . 0.0 111.105 162.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -66.06 -66.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.872 1.269 . . . . 0.0 111.078 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -153.53 -40.66 0.1 Allowed 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 -158.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.36 157.78 37.02 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.4 p -146.6 168.7 20.63 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.01 -1.056 . . . . 0.0 109.732 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -103.76 31.43 4.45 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.386 0.674 . . . . 0.0 111.0 -172.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.7 p -26.26 106.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.869 2.468 . . . . 0.0 112.734 -171.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.47 148.85 63.49 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.864 -162.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -61.99 -26.57 78.73 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.278 1.985 . . . . 0.0 112.712 -173.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -60.64 -56.36 22.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.143 170.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 70.4 m -63.65 -36.8 85.02 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 119.046 0.839 . . . . 0.0 111.629 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.63 72.18 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.136 0.88 . . . . 0.0 111.679 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 m -80.25 -46.75 15.72 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.254 1.022 . . . . 0.0 111.258 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -82.7 -26.18 32.28 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.646 0.778 . . . . 0.0 112.2 -170.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.252 1.234 1 C-N-CA 133.324 4.65 . . . . 0.0 110.3 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.151 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 m -165.89 167.81 16.42 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.382 1.873 . . . . 0.0 106.725 170.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -138.55 -176.91 4.63 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.407 1.083 . . . . 0.0 108.574 175.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 42.3 ttp -150.52 173.09 14.49 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 106.006 -1.849 . . . . 0.0 106.006 163.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 57.53 69.65 0.72 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.73 1.612 . . . . 0.0 110.831 -174.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -134.25 163.78 48.72 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.144 1.778 . . . . 0.0 108.129 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -66.89 168.52 16.87 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 N-CA-C 107.694 -1.695 . . . . 0.0 107.694 158.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.26 0.0 OUTLIER 63.26 -75.79 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.549 1.139 . . . . 0.0 112.473 -173.624 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -55.34 100.53 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.513 1.925 . . . . 0.0 112.332 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -128.42 137.62 51.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.826 1.25 . . . . 0.0 109.504 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 99.55 8.87 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.557 0.743 . . . . 0.0 109.697 174.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 71.0 mt -93.51 101.81 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.56 102.66 1.19 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.487 1.915 . . . . 0.0 109.338 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.8 t -110.23 -175.13 2.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.092 1.757 . . . . 0.0 109.75 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.86 153.89 37.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.619 1.168 . . . . 0.0 110.853 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.2 t -73.62 106.55 5.43 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.337 1.855 . . . . 0.0 108.116 169.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.0 t -57.48 -10.07 1.32 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.574 1.95 . . . . 0.0 114.372 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -114.49 -10.91 12.52 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.888 1.275 . . . . 0.0 114.346 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 p -132.61 -0.51 3.53 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.7 1.591 . . . . 0.0 114.487 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t0 52.38 23.96 2.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.0 2.52 . . . . 0.0 113.492 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.75 139.79 16.68 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.55 -1.82 . . . . 0.0 108.55 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.38 140.78 29.7 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 112.067 -162.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 mt -126.05 107.28 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -78.1 92.76 4.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.6 mt -71.5 82.74 0.81 Allowed 'General case' 0 C--N 1.344 0.327 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 m -75.68 95.34 3.39 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.04 168.22 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 124.857 1.263 . . . . 0.0 107.969 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -124.53 97.64 5.39 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 166.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 t -143.92 167.77 21.54 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.704 0.402 . . . . 0.0 111.175 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 53.7 m -87.57 168.77 12.76 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.782 -1.199 . . . . 0.0 110.458 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.36 -48.07 68.86 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.572 1.149 . . . . 0.0 112.906 -172.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.61 -50.26 65.71 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.728 -0.654 . . . . 0.0 109.976 -172.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -57.89 -43.72 86.25 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.28 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.57 -38.63 72.24 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.012 0.823 . . . . 0.0 111.58 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -44.65 64.66 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.691 1.196 . . . . 0.0 111.762 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 m -71.44 -41.73 69.09 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.974 1.309 . . . . 0.0 109.698 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.97 -38.1 64.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.36 -42.77 96.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.141 -1.023 . . . . 0.0 109.821 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -68.7 -35.88 77.74 Favored 'General case' 0 CA--C 1.504 -0.816 0 C-N-CA 118.003 -1.479 . . . . 0.0 111.916 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.8 mt -67.2 -40.55 86.48 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 118.667 -1.213 . . . . 0.0 110.52 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -72.19 -28.82 63.45 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.38 1.072 . . . . 0.0 111.308 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -71.78 -36.59 70.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.846 0.748 . . . . 0.0 111.292 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.8 t -71.3 -69.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.852 1.661 . . . . 0.0 111.936 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -150.98 -29.45 0.19 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 -158.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 166.72 16.47 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.568 0.699 . . . . 0.0 109.148 168.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.2 m -167.16 -178.37 4.1 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.439 1.896 . . . . 0.0 106.984 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.49 176.26 8.87 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.185 0.594 . . . . 0.0 110.127 -171.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.61 138.61 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 125.899 1.68 . . . . 0.0 107.693 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.9 p -80.06 154.11 74.94 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.882 0.473 . . . . 0.0 109.917 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.74 -26.96 60.24 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.54 2.16 . . . . 0.0 112.949 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.27 -61.94 2.06 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.121 0.969 . . . . 0.0 109.503 170.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 95.6 m -64.97 -34.97 79.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 118.822 -0.608 . . . . 0.0 112.277 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.31 -35.48 71.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.21 0.914 . . . . 0.0 111.43 172.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -80.61 -44.06 19.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.172 0.989 . . . . 0.0 111.248 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.405 ' N ' HD21 ' A' ' 55' ' ' ASN . 0.9 OUTLIER -76.52 -22.8 53.94 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.982 0.913 . . . . 0.0 112.506 -176.001 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 C-N-CA 130.257 3.423 . . . . 0.0 111.597 -173.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.163 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.1 p -133.4 -90.29 0.38 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -74.53 88.3 2.13 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 167.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -137.22 146.58 45.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.896 1.278 . . . . 0.0 108.504 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.84 18.03 0.79 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.34 1.856 . . . . 0.0 113.342 -172.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -85.16 155.69 60.42 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.71 0.804 . . . . 0.0 110.95 -170.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -71.46 75.96 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.784 2.989 . . . . 0.0 110.059 173.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.257 63.0 tt0 58.49 67.14 0.97 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.067 1.747 . . . . 0.0 110.027 171.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.24 100.91 0.85 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 126.014 1.725 . . . . 0.0 109.075 170.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -99.08 170.48 8.67 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.258 0.349 . . . . 0.0 110.543 173.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -116.54 123.56 47.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 168.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.9 mt -126.41 103.97 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 125.437 1.495 . . . . 0.0 107.572 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.76 109.44 2.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.924 0.89 . . . . 0.0 109.277 168.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.5 m -105.55 177.42 4.86 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.095 0.958 . . . . 0.0 109.5 167.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -135.92 155.79 36.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.521 0.677 . . . . 0.0 112.253 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.5 t -76.73 111.52 12.33 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.584 1.153 . . . . 0.0 109.098 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.0 t -61.86 -13.28 22.96 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -80.17 -50.5 10.2 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.622 1.556 . . . . 0.0 110.252 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.9 p -116.34 0.45 12.83 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.462 -161.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.8 t0 52.07 29.35 6.25 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.339 2.256 . . . . 0.0 111.653 -173.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -64.75 133.25 37.71 Favored Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -77.22 103.31 7.08 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 128.221 2.608 . . . . 0.0 109.402 -170.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.5 mt -118.61 88.93 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 122.312 1.053 . . . . 0.0 108.651 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.13 99.8 0.71 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.562 1.545 . . . . 0.0 108.896 170.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -83.5 161.93 21.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 171.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.9 t -136.12 126.0 25.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 157.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.6 m -143.77 141.96 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 -172.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -108.89 113.24 25.98 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -172.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.0 t -148.85 152.67 36.88 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.9 m -53.85 142.48 23.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.536 -1.666 . . . . 0.0 107.984 163.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.17 -35.55 17.14 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 125.493 1.517 . . . . 0.0 113.71 -171.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.38 -62.44 1.76 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.204 1.402 . . . . 0.0 110.396 -176.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -71.09 -23.56 62.14 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 122.158 -0.339 . . . . 0.0 111.022 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 tp -65.67 -40.85 92.85 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -49.64 76.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.029 0.932 . . . . 0.0 109.66 171.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.4 m -56.75 -51.38 69.12 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.979 0.809 . . . . 0.0 111.265 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.5 pp -74.74 -33.01 62.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.952 0.796 . . . . 0.0 109.742 -169.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.38 -36.66 77.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -65.76 -39.68 91.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.34 0.656 . . . . 0.0 110.971 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.4 mt -58.42 -49.73 76.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.565 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -67.02 -28.44 68.24 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.88 -35.52 67.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.794 0.725 . . . . 0.0 111.111 173.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -80.27 -71.79 0.44 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.175 1.39 . . . . 0.0 111.673 -173.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.0 m -147.38 -30.16 0.33 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.155 0.982 . . . . 0.0 113.188 -158.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.1 tp -72.21 152.75 42.02 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.9 p -142.09 173.64 11.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.969 0.907 . . . . 0.0 108.972 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -117.42 74.9 0.95 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -172.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -65.14 110.02 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.4 p -57.7 150.35 47.5 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 123.063 0.545 . . . . 0.0 110.968 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.26 -23.79 65.75 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.44 2.093 . . . . 0.0 112.615 -175.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -57.14 -55.42 34.99 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.861 0.864 . . . . 0.0 110.626 168.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 61.9 m -68.66 -29.93 68.51 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.78 0.832 . . . . 0.0 112.713 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.78 -43.85 97.71 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.163 0.892 . . . . 0.0 110.846 169.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.4 m -72.06 -45.53 60.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.562 1.145 . . . . 0.0 111.246 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -72.66 -23.52 60.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.023 0.529 . . . . 0.0 111.02 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 127.325 2.25 . . . . 0.0 110.723 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.341 0 N-CA-C 108.517 -1.833 . . . . 0.0 108.517 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 m -61.57 -8.63 4.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.579 1.151 . . . . 0.0 113.022 168.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -144.04 150.14 37.76 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 128.816 2.847 . . . . 0.0 107.077 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.3 tmm? -153.29 129.39 10.39 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 162.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -147.95 18.97 1.13 Allowed 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -84.61 149.54 54.57 Favored Pre-proline 0 C--N 1.323 -0.544 0 C-N-CA 123.102 0.561 . . . . 0.0 110.314 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.23 107.37 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.309 2.672 . . . . 0.0 109.731 -177.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 43.25 68.64 0.48 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.15 1.78 . . . . 0.0 112.936 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.4 105.61 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.404 0.681 . . . . 0.0 109.47 162.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -131.19 132.03 44.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.797 1.639 . . . . 0.0 110.053 -175.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -104.62 95.84 6.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.5 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 mt -97.13 98.14 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 -171.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 tt -62.95 101.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.476 1.11 . . . . 0.0 110.445 177.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.4 m -104.23 -177.59 3.41 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.4 0.28 . . . . 0.0 111.349 176.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.45 155.39 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 O-C-N 120.953 -1.092 . . . . 0.0 111.147 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.3 t -70.94 120.42 16.48 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.879 1.272 . . . . 0.0 108.982 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.0 t -57.42 -25.8 60.15 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.202 1.401 . . . . 0.0 113.402 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -90.29 -48.31 7.22 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.001 0.818 . . . . 0.0 111.176 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.7 p -113.92 0.9 14.55 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.797 0.839 . . . . 0.0 112.815 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.8 t70 58.77 21.11 8.59 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.787 2.035 . . . . 0.0 112.546 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.36 140.4 30.75 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -176.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -65.0 109.07 2.0 Allowed 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 127.155 2.182 . . . . 0.0 109.007 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.7 mm -96.75 151.69 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 162.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -134.59 115.9 14.39 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 120.009 -1.682 . . . . 0.0 108.379 161.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -79.37 85.66 5.16 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.2 m -71.56 74.75 0.79 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.369 0.986 . . . . 0.0 108.971 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.5 m -101.49 178.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 122.406 1.098 . . . . 0.0 109.317 -177.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.406 ' C ' ' HG ' ' A' ' 29' ' ' SER . 2.4 mp0 -129.33 113.11 14.56 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 128.394 2.677 . . . . 0.0 104.434 172.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.406 ' HG ' ' C ' ' A' ' 28' ' ' GLU . 70.7 m -157.77 125.18 5.16 Favored 'General case' 0 N--CA 1.437 -1.087 0 O-C-N 120.184 -1.572 . . . . 0.0 109.979 -169.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -65.12 151.63 45.59 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.034 1.334 . . . . 0.0 110.267 -175.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -44.06 -49.12 8.9 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.316 1.447 . . . . 0.0 114.865 -170.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.33 -36.46 58.25 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 121.29 0.567 . . . . 0.0 110.973 -167.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -47.91 75.61 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.417 1.087 . . . . 0.0 109.599 168.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.12 -39.43 94.01 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 122.0 -0.438 . . . . 0.0 111.297 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -64.0 1.04 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 167.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.2 m -51.92 -44.16 63.73 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.869 0.759 . . . . 0.0 111.005 -170.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.19 -36.22 64.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.431 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.91 -34.09 76.69 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.199 175.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -32.34 66.56 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.626 0.648 . . . . 0.0 110.697 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.39 -49.4 77.07 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.083 0.856 . . . . 0.0 110.559 170.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.46 -42.15 98.33 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.514 0.597 . . . . 0.0 110.845 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 tp -59.85 -39.59 85.7 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.509 1.123 . . . . 0.0 111.401 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.8 t -72.98 -63.65 1.13 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.562 1.145 . . . . 0.0 111.501 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -160.19 -27.09 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -158.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 tp -70.67 156.96 38.81 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.443 1.019 . . . . 0.0 109.026 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -161.92 172.63 15.71 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 125.845 1.658 . . . . 0.0 106.647 170.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -116.04 178.07 4.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.128 0.971 . . . . 0.0 109.214 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.6 131.73 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -69.47 152.12 96.49 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -62.99 -26.31 74.02 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.18 1.92 . . . . 0.0 112.65 -176.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -59.62 -59.27 5.7 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.055 0.542 . . . . 0.0 109.872 169.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.8 m -60.28 -35.17 74.93 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.865 0.757 . . . . 0.0 112.204 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.96 96.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.857 0.753 . . . . 0.0 110.672 175.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.2 m -75.24 -38.21 60.7 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.214 1.006 . . . . 0.0 111.555 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.86 -9.22 59.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.305 1.042 . . . . 0.0 111.915 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.414 10.4 pt20 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 128.953 2.901 . . . . 0.0 113.222 -171.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 108.747 -1.741 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 m -62.49 -18.88 62.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.919 0.86 . . . . 0.0 112.677 173.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -129.27 166.1 20.1 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.84 2.056 . . . . 0.0 107.176 163.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -88.43 152.89 21.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.529 0.68 . . . . 0.0 111.639 -174.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -139.06 137.06 35.91 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 160.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -140.28 162.49 49.49 Favored Pre-proline 0 C--O 1.233 0.228 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -170.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.75 146.36 97.45 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 N-CA-C 108.225 -1.49 . . . . 0.0 108.225 162.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 59.7 -58.81 0.06 Allowed 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 129.107 2.963 . . . . 0.0 114.672 -175.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 ttm-85 -63.12 92.95 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 N-CA-C 115.281 1.585 . . . . 0.0 115.281 -166.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.0 m170 -118.98 150.03 40.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.174 -1.376 . . . . 0.0 109.051 -173.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -123.57 83.91 2.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mt -90.24 97.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 tt -70.87 93.04 0.94 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 123.563 0.745 . . . . 0.0 110.016 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.4 t -81.1 171.75 14.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.145 0.978 . . . . 0.0 108.427 167.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.0 m -121.67 156.88 25.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.623 0.725 . . . . 0.0 109.571 164.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.0 t -76.88 108.22 9.77 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.218 1.407 . . . . 0.0 108.151 169.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.28 -4.66 0.88 Allowed 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -172.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -111.34 -16.87 13.27 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 120.354 1.434 . . . . 0.0 114.798 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 26.7 p -126.44 0.73 6.95 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.439 1.472 . . . . 0.0 113.952 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.1 t70 56.1 20.02 4.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.195 2.198 . . . . 0.0 112.864 -169.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.48 140.86 31.32 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 120.939 -1.101 . . . . 0.0 110.4 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 122.55 18.73 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.784 2.034 . . . . 0.0 109.724 -173.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.6 mt -124.06 99.01 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -82.7 92.6 7.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.064 0.546 . . . . 0.0 109.549 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -77.04 89.18 3.57 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -176.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.6 m -67.29 97.88 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.2 127.59 51.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 122.211 1.005 . . . . 0.0 110.204 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.88 92.35 7.77 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.7 p -132.68 142.99 49.34 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 127.313 2.245 . . . . 0.0 108.28 -158.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -83.53 -81.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 120.544 1.52 . . . . 0.0 112.393 -159.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -165.68 -61.42 0.03 OUTLIER 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.23 -40.89 70.8 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.038 1.335 . . . . 0.0 109.058 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -49.05 76.44 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.002 1.321 . . . . 0.0 109.953 171.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.57 -46.68 86.39 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.011 0.524 . . . . 0.0 110.185 178.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.72 -55.39 34.98 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.0 m -58.28 -47.84 82.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.494 -173.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -65.35 -35.15 80.09 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.329 0.513 . . . . 0.0 110.759 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.51 -43.42 98.89 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 175.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -61.71 -47.45 85.2 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.102 0.864 . . . . 0.0 109.413 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.73 -44.04 97.15 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.291 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -74.95 -24.49 58.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.489 0.716 . . . . 0.0 110.887 -175.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.46 -36.69 45.0 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.455 0.702 . . . . 0.0 111.047 169.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 t -69.01 -67.43 0.47 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.798 1.239 . . . . 0.0 111.662 -173.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.46 -41.36 0.09 Allowed 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -158.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 tp -69.68 150.01 47.44 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -143.78 167.23 22.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 124.003 0.921 . . . . 0.0 109.038 166.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -95.3 -30.35 14.0 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -162.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.4 t 61.21 113.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 127.853 2.461 . . . . 0.0 111.916 -175.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.0 p -66.36 153.56 92.44 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 120.949 -1.094 . . . . 0.0 110.343 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.13 -24.57 66.1 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 122.399 2.066 . . . . 0.0 112.704 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -58.76 -53.55 57.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.172 0.589 . . . . 0.0 110.402 170.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.1 m -66.82 -36.32 82.08 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.661 175.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.53 -28.98 67.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.1 1.318 . . . . 0.0 112.029 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.0 m -82.28 -43.97 16.86 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.53 1.132 . . . . 0.0 111.303 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.83 -40.47 22.45 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.553 0.741 . . . . 0.0 112.01 -172.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 . . . . . 0 C--O 1.256 1.397 1 C-N-CA 134.139 4.975 . . . . 0.0 112.07 172.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.052 0 N-CA-C 106.729 -2.548 . . . . 0.0 106.729 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -55.39 159.91 2.54 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 143.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -153.93 162.36 41.27 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.745 1.218 . . . . 0.0 108.643 178.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 56.2 ttm -157.31 140.41 15.33 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 162.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 128.91 90.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 131.307 3.843 . . . . 0.0 108.452 -169.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -138.89 161.19 59.57 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-O 119.107 -0.473 . . . . 0.0 109.89 -172.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.01 176.38 2.52 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.447 2.765 . . . . 0.0 110.704 171.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.297 0.9 OUTLIER 59.5 -84.8 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.978 1.711 . . . . 0.0 111.259 -169.614 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -51.29 103.45 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.936 1.244 . . . . 0.0 111.637 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -125.93 138.18 53.75 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -119.63 82.49 1.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.772 0.829 . . . . 0.0 108.91 -173.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.5 mt -90.35 101.25 12.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 -171.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 24' ' ' GLU . 2.2 tt -74.82 87.07 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.326 1.05 . . . . 0.0 110.068 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.8 t -80.02 -171.5 2.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.178 1.391 . . . . 0.0 108.846 159.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 m -139.67 164.93 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 121.153 -0.967 . . . . 0.0 111.177 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.87 112.91 5.18 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 166.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -58.51 -18.96 33.31 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.917 0.887 . . . . 0.0 113.34 -171.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -109.01 -14.75 14.49 Favored 'General case' 0 C--N 1.345 0.389 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -128.33 2.28 5.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.644 1.565 . . . . 0.0 114.054 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 57.72 20.32 6.32 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.234 1.814 . . . . 0.0 112.989 -174.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.45 150.85 52.09 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 121.082 -1.011 . . . . 0.0 110.633 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.408 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -66.51 112.01 3.88 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.705 2.002 . . . . 0.0 108.833 -172.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.0 mm -121.64 85.61 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 123.369 1.557 . . . . 0.0 108.05 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 13' ' ' LEU . 7.5 pt-20 -66.82 121.24 15.04 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.443 159.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.1 mt -86.39 75.96 9.72 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 161.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.3 m -73.77 94.88 2.31 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 165.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.67 175.55 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.829 1.651 . . . . 0.0 108.45 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -120.47 119.87 34.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 162.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -143.25 169.01 18.43 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.639 1.176 . . . . 0.0 109.491 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 m -95.94 175.46 6.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 159.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.14 79.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.405 0.682 . . . . 0.0 111.958 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.09 -40.05 82.71 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.198 0.999 . . . . 0.0 110.764 -178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -63.51 -47.91 79.74 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.378 1.471 . . . . 0.0 109.404 173.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.83 -46.62 81.57 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.675 0.79 . . . . 0.0 109.962 175.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.0 ttt180 -59.88 -52.25 66.22 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.7 m -56.91 -52.23 65.98 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.241 1.016 . . . . 0.0 111.117 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.93 -31.49 72.69 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -63.16 -44.5 95.29 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 118.323 -0.846 . . . . 0.0 109.354 172.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.32 -46.1 89.51 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.523 1.056 . . . . 0.0 110.311 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -46.87 80.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.291 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -65.73 -26.59 67.81 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.795 0.685 . . . . 0.0 112.563 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -75.67 -33.87 60.43 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.317 1.847 . . . . 0.0 111.168 172.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -75.68 -67.37 0.67 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.112 0.965 . . . . 0.0 111.23 -172.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -157.76 -36.38 0.07 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.851 1.261 . . . . 0.0 112.515 -158.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.21 154.01 40.96 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.8 p -144.3 168.37 20.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.536 1.134 . . . . 0.0 108.189 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -91.5 -57.02 2.9 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 123.328 0.393 . . . . 0.0 110.665 -176.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t 67.85 134.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.714 2.406 . . . . 0.0 110.338 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.8 p -71.44 149.55 93.76 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.686 -1.259 . . . . 0.0 109.164 174.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.12 -25.48 65.67 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.316 2.01 . . . . 0.0 113.087 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -66.61 -37.92 85.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.936 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.3 m -76.29 -27.35 56.6 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 112.024 170.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.66 74.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.957 1.708 . . . . 0.0 110.718 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.2 m -76.63 -62.5 1.61 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.139 0.976 . . . . 0.0 111.219 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -83.9 -23.71 31.1 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -167.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 . . . . . 0 C--O 1.246 0.877 0 C-N-CA 128.402 2.681 . . . . 0.0 113.449 177.822 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.897 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 t 44.86 49.21 9.13 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.865 2.466 . . . . 0.0 112.304 -173.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 -132.49 -79.04 0.5 Allowed 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 168.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.408 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 30.8 ttm -148.15 178.88 8.18 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.564 2.746 . . . . 0.0 105.657 174.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.408 ' H ' ' HG2' ' A' ' 4' ' ' MET . . . 55.43 68.55 0.85 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.567 1.547 . . . . 0.0 110.761 -173.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -138.15 156.36 73.9 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 126.022 1.729 . . . . 0.0 107.722 -177.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.55 74.87 3.64 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.572 2.848 . . . . 0.0 110.643 -177.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 56.05 62.61 2.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.385 1.874 . . . . 0.0 111.301 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.59 108.04 0.21 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 126.539 1.936 . . . . 0.0 110.804 166.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -125.97 166.37 17.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 125.097 1.359 . . . . 0.0 110.303 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.46 89.27 3.01 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.7 mt -78.98 94.65 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.24 103.31 1.55 Allowed 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 121.221 -0.925 . . . . 0.0 109.255 170.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t -104.71 179.01 4.4 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.897 0.879 . . . . 0.0 108.865 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.1 m -134.25 153.94 36.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-O 121.747 0.784 . . . . 0.0 111.027 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.6 t -73.88 115.13 12.96 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.359 1.464 . . . . 0.0 109.818 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 t -59.7 -13.34 9.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.551 1.54 . . . . 0.0 113.905 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -115.7 -11.24 11.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.7 p -136.09 1.86 2.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.943 1.701 . . . . 0.0 114.855 174.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 55.55 20.79 4.0 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 127.477 2.311 . . . . 0.0 113.5 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.92 140.88 30.8 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 120.823 -1.173 . . . . 0.0 110.265 -177.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.464 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -69.43 123.46 21.29 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.673 1.989 . . . . 0.0 109.391 -175.466 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.5 mp -119.61 106.49 19.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 164.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.464 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 41.2 tt0 -81.38 90.42 6.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.5 mt -70.2 86.42 0.57 Allowed 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.4 m -70.09 101.37 1.81 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.2 m -136.61 139.58 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.091 0.956 . . . . 0.0 108.617 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.5 mp0 -95.58 91.27 6.06 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.23 -2.137 . . . . 0.0 105.23 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.1 p -132.65 120.26 21.51 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 124.57 1.148 . . . . 0.0 109.872 -166.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -57.81 148.13 26.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.72 1.263 . . . . 0.0 109.452 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -50.9 -40.59 57.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.869 0.867 . . . . 0.0 113.042 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.9 -45.32 82.41 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.342 1.057 . . . . 0.0 111.764 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.75 -54.85 41.46 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tt -52.43 -48.63 65.64 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.039 0.936 . . . . 0.0 110.584 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -57.05 -48.09 79.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.679 0.791 . . . . 0.0 109.695 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -56.45 -50.12 72.62 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.604 0.762 . . . . 0.0 110.43 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.46 -43.7 71.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -67.5 -36.29 80.79 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.318 -169.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -62.04 -46.51 88.82 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 123.748 0.819 . . . . 0.0 109.634 173.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.03 -52.43 63.99 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 118.416 -0.802 . . . . 0.0 110.59 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -64.17 -29.23 70.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -70.67 -41.43 72.06 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.087 0.955 . . . . 0.0 111.251 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -70.15 -68.04 0.45 Allowed 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.727 1.611 . . . . 0.0 111.422 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -155.08 -34.19 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -158.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.1 tp -71.0 165.92 22.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.86 0.838 . . . . 0.0 109.154 175.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.5 m -159.38 -175.04 4.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -118.62 169.37 9.87 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.16 0.984 . . . . 0.0 108.712 -176.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.9 p -144.97 132.33 16.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.4 p -70.41 154.45 94.45 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.911 -0.566 . . . . 0.0 109.933 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -63.7 -31.59 69.19 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.243 1.962 . . . . 0.0 112.719 -174.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -56.55 -49.92 73.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.745 0.818 . . . . 0.0 110.397 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 m -68.86 -31.19 69.97 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.167 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.14 71.04 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.093 1.315 . . . . 0.0 111.513 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.99 -16.62 18.65 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -108.84 -31.25 7.76 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.562 1.073 . . . . 0.0 111.964 176.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.27 69.1 mt-30 . . . . . 0 C--O 1.255 1.361 0 C-N-CA 129.787 3.235 . . . . 0.0 115.883 176.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.441 -0.896 0 CA-C-O 117.557 -1.211 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -54.05 89.17 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -128.97 133.23 47.72 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.662 1.185 . . . . 0.0 108.748 -168.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.48 94.89 5.57 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.261 1.024 . . . . 0.0 109.327 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.3 mt -96.41 98.66 7.91 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.727 HD13 ' HD2' ' A' ' 22' ' ' ARG 0.391 0.2 OUTLIER -84.1 124.33 31.0 Favored 'General case' 0 N--CA 1.439 -0.99 0 O-C-N 120.816 -1.177 . . . . 0.0 111.688 -177.987 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.1 t -120.5 -154.94 0.6 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.284 2.234 . . . . 0.0 108.055 172.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.439 ' CG1' HH21 ' A' ' 22' ' ' ARG . 13.4 m -137.17 159.97 36.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 O-C-N 120.502 -1.374 . . . . 0.0 111.22 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.2 t -66.02 110.97 3.13 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -56.91 -11.51 1.5 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.617 1.967 . . . . 0.0 114.232 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -121.21 -14.66 8.31 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -175.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -125.66 2.79 7.53 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.08 1.309 . . . . 0.0 113.778 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.3 t70 58.13 15.91 3.55 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.861 2.464 . . . . 0.0 113.678 -177.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.06 146.83 28.35 Favored Glycine 0 C--N 1.342 0.871 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -174.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.727 ' HD2' HD13 ' A' ' 13' ' ' LEU . 1.8 tpp85 -70.92 119.14 14.61 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 124.548 1.139 . . . . 0.0 110.573 -166.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 78.6 mt -109.26 100.11 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 169.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.29 97.18 1.53 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 163.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.69 82.92 0.87 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.0 m -69.97 102.17 1.95 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -118.55 172.94 5.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 C-N-CA 124.676 1.19 . . . . 0.0 108.619 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -120.98 92.91 3.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 165.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -133.31 131.08 39.74 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.789 0.835 . . . . 0.0 109.118 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 m -62.53 162.21 10.73 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.4 62.41 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 122.904 0.482 . . . . 0.0 112.254 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -75.19 -33.98 61.49 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -67.09 -45.66 76.6 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.37 0.668 . . . . 0.0 109.421 171.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.97 -44.0 86.81 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.567 0.747 . . . . 0.0 110.158 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.79 -53.43 54.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.807 1.243 . . . . 0.0 109.392 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.6 m -59.05 -51.13 71.38 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.788 0.835 . . . . 0.0 109.984 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.16 -28.46 68.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.582 -0.723 . . . . 0.0 110.583 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -50.87 69.38 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 118.826 0.739 . . . . 0.0 109.326 170.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -62.54 -41.05 98.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -175.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.91 -49.13 77.42 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.172 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.36 -34.07 77.13 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.352 0.524 . . . . 0.0 111.635 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.0 tt -66.61 -38.67 87.45 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.191 0.996 . . . . 0.0 110.816 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.8 t -70.88 -67.57 0.5 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.331 1.452 . . . . 0.0 111.452 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -153.89 -36.63 0.1 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -158.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 tp -66.12 148.0 52.48 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.524 0.678 . . . . 0.0 109.604 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.8 m -160.5 168.14 25.72 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -121.02 174.02 6.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.853 1.661 . . . . 0.0 107.881 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.0 m -133.22 148.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 C-N-CA 126.588 1.955 . . . . 0.0 108.164 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.6 p -75.28 157.04 85.32 Favored Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -64.2 -27.0 64.45 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.188 1.925 . . . . 0.0 113.128 -174.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 43.0 t90 -58.5 -59.88 4.68 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.008 0.523 . . . . 0.0 109.767 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.2 m -58.77 -42.86 89.96 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.799 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.44 68.43 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.137 0.881 . . . . 0.0 112.409 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.1 m -79.68 -35.98 38.36 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.806 0.843 . . . . 0.0 111.241 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.77 -49.19 10.7 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 118.591 -0.719 . . . . 0.0 111.418 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 . . . . . 0 C--O 1.25 1.109 1 C-N-CA 133.966 4.907 . . . . 0.0 108.961 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.67 101.31 0.07 Allowed 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.229 1.412 . . . . 0.0 111.532 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -126.38 152.18 46.65 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.333 1.453 . . . . 0.0 109.125 -173.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -125.51 96.35 4.77 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.0 mt -97.31 97.76 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -171.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.88 102.34 0.77 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 p -98.9 -172.27 2.26 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 162.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -130.7 151.69 36.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 121.779 0.8 . . . . 0.0 110.565 174.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -70.27 106.38 3.32 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.283 1.833 . . . . 0.0 108.335 162.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -59.9 -8.73 2.38 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 114.141 -174.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -114.1 -14.74 12.34 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.9 p -122.09 -0.82 9.38 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.005 1.275 . . . . 0.0 113.307 170.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.8 t0 50.97 23.33 1.44 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.514 2.325 . . . . 0.0 112.782 -169.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.63 137.46 18.16 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -76.42 139.12 40.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.231 -0.984 . . . . 0.0 109.807 -170.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.0 mt -130.42 98.62 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -72.8 87.89 1.3 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.502 1.521 . . . . 0.0 109.552 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.0 mt -70.22 86.68 0.58 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.845 0.858 . . . . 0.0 108.79 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.3 m -72.2 105.25 3.93 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 169.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.6 m -124.28 173.49 10.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 125.365 1.466 . . . . 0.0 109.204 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -125.11 99.76 6.25 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -157.95 130.26 7.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.693 -1.255 . . . . 0.0 108.634 -164.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 m -65.67 165.77 11.93 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -158.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.0 46.89 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.193 1.397 . . . . 0.0 113.635 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.14 -50.84 62.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -54.56 -44.79 73.23 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.874 0.87 . . . . 0.0 110.543 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.48 -48.68 76.61 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.259 0.624 . . . . 0.0 110.662 174.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.15 -53.93 48.35 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 m -58.97 -49.87 76.24 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 124.162 0.985 . . . . 0.0 110.467 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.91 -32.72 74.56 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.32 0.964 . . . . 0.0 111.493 176.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -57.86 -45.84 85.7 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 173.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -60.19 -42.05 94.21 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 118.909 0.777 . . . . 0.0 110.364 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.9 mt -59.48 -49.96 75.75 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.109 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -65.97 -33.36 75.64 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.174 0.443 . . . . 0.0 111.61 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.26 -38.59 90.79 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.829 0.74 . . . . 0.0 111.391 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 t -74.31 -58.94 2.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.63 1.172 . . . . 0.0 111.168 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.1 m -163.37 -23.24 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.45 142.97 58.24 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 120.074 1.307 . . . . 0.0 110.056 -173.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.3 m -155.79 166.72 32.64 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 165.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -119.77 -172.88 2.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -165.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.52 126.86 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.4 p -68.73 150.32 97.67 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.93 -28.66 66.87 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.143 1.895 . . . . 0.0 113.523 -169.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -61.44 -49.82 75.29 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.808 0.443 . . . . 0.0 110.792 171.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.6 m -68.15 -32.78 73.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.842 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.01 -32.08 73.63 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 120.012 1.278 . . . . 0.0 111.437 173.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.8 m -76.48 -49.74 15.81 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.428 1.091 . . . . 0.0 110.928 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -85.69 -16.72 38.14 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.767 0.827 . . . . 0.0 112.544 -173.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 131.038 3.735 . . . . 0.0 114.956 -177.985 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.258 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.622 0 CA-C-O 118.058 -0.973 . . . . 0.0 111.22 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -53.3 92.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.478 2.311 . . . . 0.0 112.586 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -126.47 160.92 29.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.138 0.975 . . . . 0.0 110.167 -175.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -133.45 98.09 4.13 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.275 -0.89 . . . . 0.0 110.254 -168.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.2 mm -86.95 100.22 9.51 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.519 HD21 ' HD3' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -66.83 86.75 0.13 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.108 0.963 . . . . 0.0 109.68 173.756 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.4 t -89.26 176.73 6.83 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.332 1.453 . . . . 0.0 110.018 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -123.75 158.48 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.322 1.049 . . . . 0.0 110.318 163.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -73.99 115.16 13.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.637 1.975 . . . . 0.0 109.351 169.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.5 t -55.95 -24.44 38.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.066 1.746 . . . . 0.0 113.977 -173.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.44 -41.87 9.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.88 1.218 . . . . 0.0 112.723 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -110.93 -3.64 15.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.7 t0 49.8 38.53 15.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.691 1.996 . . . . 0.0 112.054 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.2 144.86 17.37 Favored Glycine 0 C--N 1.341 0.829 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 170.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.519 ' HD3' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -81.5 149.62 28.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.909 -165.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.94 108.46 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -80.31 91.9 5.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.791 0.836 . . . . 0.0 108.762 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -74.81 87.16 2.24 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -176.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -71.45 95.68 1.4 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 171.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -104.62 172.57 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.383 1.473 . . . . 0.0 109.503 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -123.57 107.47 11.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.217 -1.771 . . . . 0.0 106.217 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.3 t -151.17 169.19 22.48 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.998 0.519 . . . . 0.0 109.808 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.6 m -82.34 170.28 15.52 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.555 -1.341 . . . . 0.0 110.643 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.03 74.42 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.186 0.594 . . . . 0.0 111.285 -174.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 32' ' ' GLU . 1.7 mp0 -62.3 -52.73 62.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.76 2.024 . . . . 0.0 109.918 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.88 -46.74 77.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.486 1.114 . . . . 0.0 109.818 177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.96 -47.19 68.32 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.119 0.418 . . . . 0.0 111.065 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -64.72 -49.65 70.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.4 m -58.69 -50.12 75.04 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.445 0.298 . . . . 0.0 110.365 -176.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.89 -31.94 72.87 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.875 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.23 -41.97 89.92 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 119.611 1.096 . . . . 0.0 108.724 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -63.67 -43.6 96.22 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-N 119.264 0.938 . . . . 0.0 110.313 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.42 -42.7 99.15 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.261 0.482 . . . . 0.0 112.002 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -73.89 -30.82 62.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.788 0.435 . . . . 0.0 111.231 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.3 mt -69.44 -35.61 75.85 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.923 0.783 . . . . 0.0 111.131 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.3 t -67.58 -68.9 0.35 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.461 1.505 . . . . 0.0 110.935 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -36.65 0.1 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -158.566 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.14 153.0 43.67 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.481 0.658 . . . . 0.0 109.76 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.5 m -165.79 167.87 16.54 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 126.017 1.727 . . . . 0.0 107.126 170.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -115.97 -179.72 3.74 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.214 1.405 . . . . 0.0 108.854 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -134.48 132.66 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 126.766 2.027 . . . . 0.0 105.856 -178.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.1 p -70.14 151.52 95.96 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -62.03 -30.95 83.64 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.929 1.752 . . . . 0.0 112.125 -175.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -56.89 -48.68 77.63 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.287 0.494 . . . . 0.0 111.066 171.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.1 m -69.69 -28.32 65.74 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.278 -0.867 . . . . 0.0 112.413 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.65 81.59 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.378 0.99 . . . . 0.0 110.213 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.8 m -65.55 -47.94 74.13 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.868 0.867 . . . . 0.0 112.006 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.62 -24.0 59.97 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.276 0.489 . . . . 0.0 111.669 -176.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 127.596 2.358 . . . . 0.0 112.621 170.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -64.59 101.68 0.48 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.656 1.582 . . . . 0.0 112.73 -172.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -135.48 109.98 8.52 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.152 -1.386 . . . . 0.0 109.989 -159.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -87.11 110.89 20.42 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.91 1.284 . . . . 0.0 108.837 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.0 mt -112.08 98.47 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.87 110.72 2.97 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.218 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.9 t -109.65 -179.21 3.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.407 0.683 . . . . 0.0 109.98 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.3 m -136.95 153.29 29.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 122.051 0.929 . . . . 0.0 112.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 48' ' ' VAL . 45.4 t -65.38 119.37 10.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.675 163.287 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.4 t -56.52 -18.67 12.36 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.29 1.436 . . . . 0.0 114.657 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HE3' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -125.28 -16.92 5.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -164.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.9 p -121.71 0.63 9.87 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.816 0.846 . . . . 0.0 113.072 169.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.59 19.85 4.52 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.302 1.841 . . . . 0.0 112.647 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.0 131.46 36.41 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -71.88 114.67 10.22 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 127.286 2.234 . . . . 0.0 109.621 -169.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.1 mm -110.15 134.57 51.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -105.91 93.28 4.55 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 174.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -79.68 82.49 5.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . 0.339 5.7 t -73.62 103.52 4.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 117.514 -1.674 . . . . 0.0 108.674 161.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.73 172.02 1.19 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 158.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.61 93.71 3.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 160.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.2 t -158.05 171.73 19.71 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.67 0.388 . . . . 0.0 111.256 -167.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.1 t -68.47 166.7 16.32 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.852 0.834 . . . . 0.0 111.678 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.72 72.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.951 1.3 . . . . 0.0 111.369 167.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -68.14 -48.79 64.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.025 0.93 . . . . 0.0 110.057 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -67.94 -46.27 71.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.802 1.241 . . . . 0.0 109.865 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tt -48.91 -51.61 29.09 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 118.348 0.522 . . . . 0.0 110.271 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -59.93 -55.86 28.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 m -53.17 -53.04 56.34 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.193 0.997 . . . . 0.0 110.063 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -34.85 79.21 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.058 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.47 -46.86 88.53 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 117.185 -1.388 . . . . 0.0 109.476 170.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -46.36 82.35 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 121.128 1.785 . . . . 0.0 109.862 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -70.45 -43.63 69.47 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.428 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -67.44 -23.36 65.51 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.35 -34.18 48.58 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.262 1.825 . . . . 0.0 110.844 171.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.3 t -66.75 -67.54 0.44 Allowed 'General case' 0 C--N 1.339 0.152 0 C-N-CA 124.302 1.041 . . . . 0.0 110.287 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -44.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.775 0.83 . . . . 0.0 112.384 -158.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.01 139.09 55.25 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -144.96 161.98 38.03 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -172.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -118.31 68.75 0.78 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 117.963 0.347 . . . . 0.0 110.919 -158.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.408 ' HA ' ' SG ' ' A' ' 16' ' ' CYS . 35.7 m -62.33 113.19 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-O 121.64 0.733 . . . . 0.0 109.671 -177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.1 p -57.97 152.96 36.24 Favored Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 124.21 1.004 . . . . 0.0 110.317 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -63.72 -25.87 68.53 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.303 2.002 . . . . 0.0 113.096 -171.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.3 t90 -60.79 -53.32 58.81 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.292 0.497 . . . . 0.0 109.848 169.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.409 ' SG ' ' HE3' ' A' ' 18' ' ' LYS . 10.0 m -62.62 -36.74 83.76 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.919 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.5 88.61 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.597 0.635 . . . . 0.0 111.296 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 m -74.06 -42.06 60.8 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.306 1.042 . . . . 0.0 111.402 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -86.67 -19.86 28.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.436 0.694 . . . . 0.0 112.336 -172.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.549 2.34 . . . . 0.0 111.156 -173.095 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -55.0 93.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 127.522 2.329 . . . . 0.0 111.478 172.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.6 m170 -125.29 143.97 50.7 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.888 1.275 . . . . 0.0 110.451 -168.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.57 82.19 1.68 Allowed 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.118 0.567 . . . . 0.0 109.711 -176.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.82 100.91 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -72.56 100.06 2.67 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 120.928 -1.107 . . . . 0.0 109.778 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.45 -173.94 4.77 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 160.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.45 159.41 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.641 1.176 . . . . 0.0 110.01 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.27 113.28 9.14 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.769 2.028 . . . . 0.0 108.558 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.4 t -56.9 -18.65 14.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.17 1.788 . . . . 0.0 113.458 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.32 -16.19 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.0 p -129.9 -0.8 4.75 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.749 1.613 . . . . 0.0 114.475 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 55.1 24.06 5.8 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.556 1.943 . . . . 0.0 113.217 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.56 146.37 28.61 Favored Glycine 0 C--N 1.34 0.78 0 N-CA-C 108.714 -1.754 . . . . 0.0 108.714 175.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.79 141.12 39.42 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.613 -166.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mm -121.93 94.09 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -74.25 95.46 2.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.321 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.94 74.06 5.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.3 m -75.39 96.65 3.46 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 167.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.92 157.48 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 C-N-CA 126.143 1.777 . . . . 0.0 108.589 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -104.82 102.59 12.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 -178.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -151.97 156.73 40.61 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 118.057 0.39 . . . . 0.0 110.283 173.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 163.33 21.72 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.234 0.614 . . . . 0.0 111.928 -174.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.61 -34.89 74.91 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.643 0.777 . . . . 0.0 111.329 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.65 -48.92 78.65 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.323 1.849 . . . . 0.0 110.547 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -69.18 -46.99 66.13 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.949 0.9 . . . . 0.0 109.857 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -50.12 -46.14 53.51 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.285 0.634 . . . . 0.0 110.881 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -66.22 -51.79 54.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.8 0.84 . . . . 0.0 109.416 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.6 m -58.05 -51.99 67.39 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.997 0.919 . . . . 0.0 110.078 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.67 -31.44 72.66 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.138 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.39 -51.68 61.78 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.296 0.953 . . . . 0.0 108.871 170.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -59.65 -43.77 93.79 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.31 -47.2 86.28 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.164 0.438 . . . . 0.0 112.053 177.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -71.86 -25.74 62.07 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.034 0.534 . . . . 0.0 112.315 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.97 -43.26 75.33 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.389 0.995 . . . . 0.0 110.561 166.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.7 t -66.85 -54.89 17.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.747 1.219 . . . . 0.0 111.22 -172.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 83.2 m -160.25 -27.18 0.06 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 156.78 38.14 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 120.027 1.285 . . . . 0.0 110.685 -171.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.1 m -164.96 171.24 14.26 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.744 1.617 . . . . 0.0 108.35 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -128.38 -179.95 5.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.738 1.215 . . . . 0.0 109.425 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.3 p -147.07 136.83 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.613 1.565 . . . . 0.0 107.146 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.6 p -72.78 154.58 91.17 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.147 -0.454 . . . . 0.0 109.947 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.9 -27.54 58.78 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.34 2.027 . . . . 0.0 112.819 -177.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -58.25 -57.62 12.07 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.063 0.545 . . . . 0.0 109.54 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 m -59.76 -39.5 85.04 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.633 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.537 1.062 . . . . 0.0 111.4 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -76.82 -31.83 57.19 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.455 1.102 . . . . 0.0 111.782 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.98 -6.71 41.75 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.272 1.029 . . . . 0.0 112.705 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.322 14.8 pt20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 129.581 3.152 . . . . 0.0 113.856 -171.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 123.889 1.805 . . . . 0.0 113.483 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -66.12 88.48 0.12 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 110.743 -2.935 . . . . 0.0 108.246 167.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.8 m170 -105.26 173.61 6.23 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.564 1.946 . . . . 0.0 110.683 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.22 93.72 3.64 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 125.345 1.458 . . . . 0.0 107.77 175.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 mt -95.09 100.31 10.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -173.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.8 tt -66.69 112.06 4.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.763 0.825 . . . . 0.0 109.453 175.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 p -108.54 -169.91 1.58 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.125 0.57 . . . . 0.0 110.35 160.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -125.08 165.75 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 122.94 0.496 . . . . 0.0 109.85 165.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.5 t -68.16 124.19 22.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.123 1.369 . . . . 0.0 107.653 160.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.87 -7.05 6.98 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -172.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -137.72 -8.68 1.64 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.6 p -128.75 1.58 5.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.883 1.273 . . . . 0.0 110.469 167.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.73 29.55 9.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.301 2.64 . . . . 0.0 112.49 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.49 141.95 25.32 Favored Glycine 0 C--N 1.339 0.701 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -71.51 120.7 17.46 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 126.766 2.026 . . . . 0.0 110.586 -170.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.53 106.98 18.58 Favored 'Isoleucine or valine' 0 C--N 1.346 0.428 0 CA-C-N 119.928 1.24 . . . . 0.0 108.175 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -79.86 92.46 5.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.832 0.853 . . . . 0.0 109.362 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.4 mt -69.45 90.18 0.52 Allowed 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.1 m -74.88 100.37 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.72 154.2 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 124.421 1.089 . . . . 0.0 109.325 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -113.8 110.11 19.62 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.2 m -155.15 112.6 3.35 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -160.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.4 m -71.13 156.48 39.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.978 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.96 -38.48 62.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -166.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.95 -56.2 9.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.722 1.209 . . . . 0.0 110.664 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -56.97 -38.04 72.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.355 1.862 . . . . 0.0 111.402 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.22 -42.95 96.37 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.381 1.472 . . . . 0.0 109.174 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.92 -42.51 98.25 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.314 0.646 . . . . 0.0 110.367 173.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.6 m -60.96 -54.47 44.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.757 0.708 . . . . 0.0 110.196 175.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.42 -29.64 68.35 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.989 0.813 . . . . 0.0 111.891 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -55.74 -51.4 67.49 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 125.72 1.608 . . . . 0.0 108.183 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -70.63 -33.38 70.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.013 0.525 . . . . 0.0 111.102 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.13 -50.48 71.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.53 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -62.94 -34.63 77.88 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.801 0.728 . . . . 0.0 111.446 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 tt -68.62 -37.78 80.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 0.0 110.711 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 t -70.83 -69.34 0.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.575 1.55 . . . . 0.0 111.796 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -154.9 -32.08 0.1 Allowed 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -158.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.7 tp -64.09 129.12 38.73 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.355 0.662 . . . . 0.0 109.531 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -133.87 166.5 22.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 168.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -122.89 167.45 13.54 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.271 1.428 . . . . 0.0 107.961 -174.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.2 t -140.13 132.67 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -174.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.8 p -69.31 153.43 95.9 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.6 -28.93 69.87 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.096 1.864 . . . . 0.0 113.086 -172.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -59.72 -60.31 4.04 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.521 0.601 . . . . 0.0 109.71 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.5 m -54.96 -43.8 73.8 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.902 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.57 74.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.812 0.733 . . . . 0.0 111.997 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.37 -25.15 39.32 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.345 1.058 . . . . 0.0 112.007 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -104.75 -12.27 16.41 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.614 0.765 . . . . 0.0 112.841 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 116.925 -1.512 . . . . 0.0 112.869 169.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 . . . . . 0 N--CA 1.441 -0.912 0 CA-C-O 117.1 -1.429 . . . . 0.0 112.89 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 110.16 0.7 Allowed 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 121.227 1.83 . . . . 0.0 110.739 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.44 164.8 28.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.524 -1.216 . . . . 0.0 108.721 -176.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.16 117.11 17.07 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -114.79 100.75 11.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.9 tp -72.05 86.24 1.03 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.609 1.964 . . . . 0.0 110.152 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -90.12 -171.66 3.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.458 0.703 . . . . 0.0 109.422 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.93 154.2 39.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 123.181 0.592 . . . . 0.0 110.526 170.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.86 106.47 2.3 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.717 1.207 . . . . 0.0 107.792 162.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.19 -3.18 0.79 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -172.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.65 -16.94 11.23 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 30.5 p -120.05 2.41 10.95 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.117 1.326 . . . . 0.0 112.688 170.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.2 t0 54.21 21.35 3.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.436 2.294 . . . . 0.0 112.578 -171.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.42 129.15 16.73 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -55.32 113.1 1.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 129.254 3.022 . . . . 0.0 108.681 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.251 0.6 OUTLIER -126.55 106.49 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 122.679 1.228 . . . . 0.0 109.327 -172.387 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -87.5 94.26 9.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.254 1.021 . . . . 0.0 109.097 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.65 87.04 1.65 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.9 m -71.79 101.79 2.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 170.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.9 m -107.33 170.41 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.046 1.338 . . . . 0.0 108.463 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -134.25 83.7 2.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 168.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.7 t -154.96 156.7 36.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.712 0.805 . . . . 0.0 109.498 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -72.38 166.28 22.85 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.717 0.807 . . . . 0.0 112.037 -172.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.07 -39.92 63.66 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.077 1.351 . . . . 0.0 113.708 -172.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.43 -42.08 88.22 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.93 0.892 . . . . 0.0 111.369 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -74.07 -41.45 61.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.749 0.82 . . . . 0.0 110.124 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.18 -50.48 49.16 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.287 0.635 . . . . 0.0 110.46 167.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.0 ttt-85 -64.63 -41.95 95.82 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 124.418 1.087 . . . . 0.0 110.628 -177.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 m -63.08 -53.81 47.76 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.817 0.447 . . . . 0.0 110.66 176.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.63 -30.85 69.66 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.144 0.577 . . . . 0.0 110.844 -174.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.13 -59.79 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.262 1.425 . . . . 0.0 108.098 164.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -59.94 -35.72 75.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 117.083 -1.437 . . . . 0.0 111.705 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -46.99 68.63 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.278 1.399 . . . . 0.0 113.903 167.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -67.1 -1.53 4.38 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -114.88 -27.91 7.24 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 126.356 1.862 . . . . 0.0 108.478 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.3 p -77.05 -52.31 9.54 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.257 0.551 . . . . 0.0 111.175 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -157.11 -39.93 0.07 Allowed 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.845 1.258 . . . . 0.0 113.007 -158.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.62 163.17 23.84 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.266 0.555 . . . . 0.0 110.198 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -144.69 170.45 16.07 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 168.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -91.1 -30.18 16.88 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.064 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.4 t 57.48 104.72 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 127.263 2.225 . . . . 0.0 111.942 -175.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.03 150.0 31.91 Favored Pre-proline 0 CA--C 1.537 0.472 0 O-C-N 121.352 -0.842 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.43 -25.72 63.27 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.27 1.98 . . . . 0.0 113.053 -172.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.99 -49.79 76.28 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 169.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 41.7 m -67.6 -34.06 76.25 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.828 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.48 67.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.998 1.272 . . . . 0.0 111.814 174.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -86.08 -52.56 5.61 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.881 1.272 . . . . 0.0 111.043 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -83.6 -18.4 38.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.373 1.069 . . . . 0.0 112.526 -171.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 . . . . . 0 C--O 1.248 0.991 0 C-N-CA 129.752 3.221 . . . . 0.0 113.606 171.646 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -52.74 100.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.657 1.583 . . . . 0.0 111.177 173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -130.13 153.43 48.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.878 1.271 . . . . 0.0 109.546 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -121.88 118.05 27.99 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.978 0.911 . . . . 0.0 108.653 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.5 mt -117.73 101.12 11.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.38 105.38 3.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.314 -0.867 . . . . 0.0 109.323 172.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.0 t -102.52 -179.76 4.07 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.406 1.082 . . . . 0.0 108.387 169.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -131.5 156.46 42.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.828 0.823 . . . . 0.0 109.292 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.31 99.71 2.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 162.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -58.78 -2.05 0.2 Allowed 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.194 1.554 . . . . 0.0 115.194 -173.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -114.69 -14.3 12.03 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.049 1.34 . . . . 0.0 114.449 177.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.4 p -126.08 1.32 7.22 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.565 1.529 . . . . 0.0 113.688 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.2 t0 52.4 25.57 3.59 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.446 2.698 . . . . 0.0 113.668 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.75 137.78 26.21 Favored Glycine 0 C--N 1.34 0.759 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -70.76 124.01 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 126.528 1.931 . . . . 0.0 109.201 -176.562 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.44 97.36 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 40.3 tt0 -79.26 95.43 5.66 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.08 80.61 2.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -177.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -70.16 100.79 1.72 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 164.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.3 m -113.96 173.59 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 125.057 1.343 . . . . 0.0 108.977 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -124.35 104.44 8.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 162.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.41 ' OG ' ' OD2' ' A' ' 33' ' ' ASP . 5.6 t -154.43 155.5 35.08 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.013 0.824 . . . . 0.0 111.136 175.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.0 m -70.24 160.66 31.76 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.773 0.829 . . . . 0.0 111.626 -176.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.57 -42.36 67.49 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.307 1.043 . . . . 0.0 113.008 -173.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -70.53 -41.94 71.88 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.791 0.437 . . . . 0.0 111.12 -171.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.41 ' OD2' ' OG ' ' A' ' 29' ' ' SER . 16.2 t70 -64.43 -47.46 79.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.843 0.857 . . . . 0.0 109.609 171.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tt -54.71 -40.4 69.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.89 -0.506 . . . . 0.0 111.504 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -70.22 -40.8 74.31 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 121.133 -0.979 . . . . 0.0 111.471 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.9 m -65.73 -47.95 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.567 0.747 . . . . 0.0 110.327 177.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.03 -34.48 59.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -171.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.23 -47.92 80.41 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 118.127 -0.94 . . . . 0.0 108.933 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.09 -33.4 75.4 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.2 -1.4 . . . . 0.0 112.098 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.9 -42.93 89.6 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 118.497 -1.281 . . . . 0.0 110.03 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -69.42 -27.28 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.985 0.914 . . . . 0.0 112.295 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.29 -39.26 65.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.474 0.71 . . . . 0.0 110.983 171.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.7 t -71.73 -69.11 0.41 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.992 1.717 . . . . 0.0 111.943 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.85 -35.63 0.11 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -158.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.16 165.54 23.38 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -146.49 172.75 13.07 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 125.311 1.444 . . . . 0.0 107.722 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -79.53 -50.35 10.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.911 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t 66.19 125.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.589 2.356 . . . . 0.0 111.269 -172.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.9 p -71.49 152.72 93.92 Favored Pre-proline 0 CA--C 1.538 0.506 0 O-C-N 120.934 -1.104 . . . . 0.0 109.961 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.76 -25.48 60.91 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.228 1.952 . . . . 0.0 112.94 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.94 -56.39 22.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.289 0.495 . . . . 0.0 109.733 170.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.8 m -63.57 -35.59 80.99 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.471 0.578 . . . . 0.0 111.773 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.65 71.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.569 1.077 . . . . 0.0 111.545 174.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.6 m -80.56 -42.65 21.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.281 1.032 . . . . 0.0 111.389 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -85.55 -18.5 33.24 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.662 0.785 . . . . 0.0 112.573 -173.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 130.653 3.581 . . . . 0.0 110.779 -173.449 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.3 mm-40 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.507 ' HG3' HH11 ' A' ' 9' ' ' ARG . 0.0 OUTLIER -61.04 86.0 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 129.075 2.95 . . . . 0.0 111.774 -172.263 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -122.21 152.45 39.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.178 1.391 . . . . 0.0 109.196 -171.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.74 101.79 6.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.5 mt -107.82 102.13 13.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -74.37 103.19 4.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.239 -0.913 . . . . 0.0 109.933 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.3 t -96.17 -177.45 3.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.226 1.41 . . . . 0.0 108.562 168.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.16 158.74 42.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.915 0.864 . . . . 0.0 110.486 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.1 t -74.56 98.95 3.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 164.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 29.3 t -57.37 -15.4 6.39 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -172.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -95.54 -15.36 22.91 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 117.55 -1.214 . . . . 0.0 114.051 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -129.4 1.05 5.08 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 120.588 1.54 . . . . 0.0 114.134 175.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t0 52.43 22.56 2.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 128.349 2.659 . . . . 0.0 113.423 -171.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.45 143.28 38.64 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.92 118.58 14.95 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.071 2.148 . . . . 0.0 110.21 -173.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.0 mt -124.69 90.82 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-O 122.143 0.973 . . . . 0.0 108.78 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.33 100.8 0.86 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.575 1.15 . . . . 0.0 109.71 170.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 mt -79.82 73.47 6.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -69.09 102.16 1.58 Allowed 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.5 m -124.08 170.92 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 125.611 1.564 . . . . 0.0 108.908 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -120.91 99.49 6.54 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 t -150.89 156.24 40.81 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-O 120.896 0.379 . . . . 0.0 110.872 178.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -67.63 162.06 24.4 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.749 0.82 . . . . 0.0 111.68 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.85 65.95 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.522 1.129 . . . . 0.0 112.546 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -72.73 -37.05 67.88 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.13 0.572 . . . . 0.0 111.638 -171.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.43 -44.69 74.41 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.575 0.75 . . . . 0.0 109.767 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.44 -45.61 66.07 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 118.271 0.487 . . . . 0.0 110.365 170.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.86 76.0 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.617 0.767 . . . . 0.0 109.984 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.7 m -60.59 -47.01 88.07 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 124.005 0.922 . . . . 0.0 110.383 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.47 -35.71 46.27 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -171.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.12 -34.91 79.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -67.35 -50.75 58.6 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.549 0.613 . . . . 0.0 111.174 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.05 -41.63 96.95 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.596 0.635 . . . . 0.0 111.63 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -83.76 -11.94 56.4 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.041 0.536 . . . . 0.0 111.975 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.6 mt -83.79 -34.59 24.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.362 0.983 . . . . 0.0 111.105 162.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -66.06 -66.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.872 1.269 . . . . 0.0 111.078 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -153.53 -40.66 0.1 Allowed 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 -158.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.36 157.78 37.02 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.4 p -146.6 168.7 20.63 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.01 -1.056 . . . . 0.0 109.732 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -103.76 31.43 4.45 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.386 0.674 . . . . 0.0 111.0 -172.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.7 p -26.26 106.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.869 2.468 . . . . 0.0 112.734 -171.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.47 148.85 63.49 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.864 -162.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -61.99 -26.57 78.73 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.278 1.985 . . . . 0.0 112.712 -173.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -60.64 -56.36 22.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.143 170.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 70.4 m -63.65 -36.8 85.02 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 119.046 0.839 . . . . 0.0 111.629 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.63 72.18 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.136 0.88 . . . . 0.0 111.679 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 m -80.25 -46.75 15.72 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.254 1.022 . . . . 0.0 111.258 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -82.7 -26.18 32.28 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.646 0.778 . . . . 0.0 112.2 -170.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.252 1.234 1 C-N-CA 133.324 4.65 . . . . 0.0 110.3 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.26 1.1 mp0 . . . . . 0 N--CA 1.447 -0.581 0 CA-C-O 118.675 -0.679 . . . . 0.0 112.473 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -55.34 100.53 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.513 1.925 . . . . 0.0 112.332 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -128.42 137.62 51.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.826 1.25 . . . . 0.0 109.504 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 99.55 8.87 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.557 0.743 . . . . 0.0 109.697 174.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 71.0 mt -93.51 101.81 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.56 102.66 1.19 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.487 1.915 . . . . 0.0 109.338 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.8 t -110.23 -175.13 2.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.092 1.757 . . . . 0.0 109.75 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.86 153.89 37.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.619 1.168 . . . . 0.0 110.853 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.2 t -73.62 106.55 5.43 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.337 1.855 . . . . 0.0 108.116 169.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.0 t -57.48 -10.07 1.32 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.574 1.95 . . . . 0.0 114.372 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -114.49 -10.91 12.52 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.888 1.275 . . . . 0.0 114.346 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 p -132.61 -0.51 3.53 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.7 1.591 . . . . 0.0 114.487 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t0 52.38 23.96 2.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.0 2.52 . . . . 0.0 113.492 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.75 139.79 16.68 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.55 -1.82 . . . . 0.0 108.55 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.38 140.78 29.7 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 112.067 -162.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 mt -126.05 107.28 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -78.1 92.76 4.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.6 mt -71.5 82.74 0.81 Allowed 'General case' 0 C--N 1.344 0.327 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 m -75.68 95.34 3.39 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.04 168.22 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 124.857 1.263 . . . . 0.0 107.969 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -124.53 97.64 5.39 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 166.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 t -143.92 167.77 21.54 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.704 0.402 . . . . 0.0 111.175 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 53.7 m -87.57 168.77 12.76 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.782 -1.199 . . . . 0.0 110.458 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.36 -48.07 68.86 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.572 1.149 . . . . 0.0 112.906 -172.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.61 -50.26 65.71 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.728 -0.654 . . . . 0.0 109.976 -172.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -57.89 -43.72 86.25 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.28 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.57 -38.63 72.24 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.012 0.823 . . . . 0.0 111.58 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -44.65 64.66 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.691 1.196 . . . . 0.0 111.762 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 m -71.44 -41.73 69.09 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.974 1.309 . . . . 0.0 109.698 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.97 -38.1 64.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.36 -42.77 96.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.141 -1.023 . . . . 0.0 109.821 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -68.7 -35.88 77.74 Favored 'General case' 0 CA--C 1.504 -0.816 0 C-N-CA 118.003 -1.479 . . . . 0.0 111.916 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.8 mt -67.2 -40.55 86.48 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 118.667 -1.213 . . . . 0.0 110.52 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -72.19 -28.82 63.45 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.38 1.072 . . . . 0.0 111.308 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -71.78 -36.59 70.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.846 0.748 . . . . 0.0 111.292 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.8 t -71.3 -69.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.852 1.661 . . . . 0.0 111.936 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -150.98 -29.45 0.19 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 -158.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 166.72 16.47 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.568 0.699 . . . . 0.0 109.148 168.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.2 m -167.16 -178.37 4.1 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.439 1.896 . . . . 0.0 106.984 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.49 176.26 8.87 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.185 0.594 . . . . 0.0 110.127 -171.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.61 138.61 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 125.899 1.68 . . . . 0.0 107.693 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.9 p -80.06 154.11 74.94 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.882 0.473 . . . . 0.0 109.917 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.74 -26.96 60.24 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.54 2.16 . . . . 0.0 112.949 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.27 -61.94 2.06 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.121 0.969 . . . . 0.0 109.503 170.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 95.6 m -64.97 -34.97 79.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 118.822 -0.608 . . . . 0.0 112.277 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.31 -35.48 71.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.21 0.914 . . . . 0.0 111.43 172.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -80.61 -44.06 19.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.172 0.989 . . . . 0.0 111.248 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.52 -22.8 53.94 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.982 0.913 . . . . 0.0 112.506 -176.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 C-N-CA 130.257 3.423 . . . . 0.0 111.597 -173.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.257 63.0 tt0 . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 122.343 1.068 . . . . 0.0 110.027 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.24 100.91 0.85 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 126.014 1.725 . . . . 0.0 109.075 170.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -99.08 170.48 8.67 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.258 0.349 . . . . 0.0 110.543 173.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -116.54 123.56 47.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 168.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.9 mt -126.41 103.97 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 125.437 1.495 . . . . 0.0 107.572 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.76 109.44 2.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.924 0.89 . . . . 0.0 109.277 168.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.5 m -105.55 177.42 4.86 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.095 0.958 . . . . 0.0 109.5 167.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -135.92 155.79 36.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.521 0.677 . . . . 0.0 112.253 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.403 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 47.5 t -76.73 111.52 12.33 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.584 1.153 . . . . 0.0 109.098 169.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.0 t -61.86 -13.28 22.96 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -80.17 -50.5 10.2 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.622 1.556 . . . . 0.0 110.252 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.403 ' HG ' ' HG ' ' A' ' 16' ' ' CYS . 28.9 p -116.34 0.45 12.83 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.462 -161.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.8 t0 52.07 29.35 6.25 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.339 2.256 . . . . 0.0 111.653 -173.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -64.75 133.25 37.71 Favored Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -77.22 103.31 7.08 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 128.221 2.608 . . . . 0.0 109.402 -170.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.5 mt -118.61 88.93 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 122.312 1.053 . . . . 0.0 108.651 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.13 99.8 0.71 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.562 1.545 . . . . 0.0 108.896 170.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -83.5 161.93 21.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 171.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.9 t -136.12 126.0 25.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 157.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.6 m -143.77 141.96 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 -172.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -108.89 113.24 25.98 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -172.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.0 t -148.85 152.67 36.88 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.9 m -53.85 142.48 23.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.536 -1.666 . . . . 0.0 107.984 163.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.17 -35.55 17.14 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 125.493 1.517 . . . . 0.0 113.71 -171.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.38 -62.44 1.76 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.204 1.402 . . . . 0.0 110.396 -176.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -71.09 -23.56 62.14 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 122.158 -0.339 . . . . 0.0 111.022 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 tp -65.67 -40.85 92.85 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -49.64 76.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.029 0.932 . . . . 0.0 109.66 171.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.4 m -56.75 -51.38 69.12 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.979 0.809 . . . . 0.0 111.265 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.5 pp -74.74 -33.01 62.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.952 0.796 . . . . 0.0 109.742 -169.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.38 -36.66 77.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -65.76 -39.68 91.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.34 0.656 . . . . 0.0 110.971 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.4 mt -58.42 -49.73 76.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.565 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -67.02 -28.44 68.24 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.88 -35.52 67.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.794 0.725 . . . . 0.0 111.111 173.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -80.27 -71.79 0.44 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.175 1.39 . . . . 0.0 111.673 -173.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.0 m -147.38 -30.16 0.33 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.155 0.982 . . . . 0.0 113.188 -158.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.1 tp -72.21 152.75 42.02 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.9 p -142.09 173.64 11.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.969 0.907 . . . . 0.0 108.972 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -117.42 74.9 0.95 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -172.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -65.14 110.02 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.4 p -57.7 150.35 47.5 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 123.063 0.545 . . . . 0.0 110.968 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.26 -23.79 65.75 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.44 2.093 . . . . 0.0 112.615 -175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -57.14 -55.42 34.99 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.861 0.864 . . . . 0.0 110.626 168.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 61.9 m -68.66 -29.93 68.51 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.78 0.832 . . . . 0.0 112.713 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.78 -43.85 97.71 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.163 0.892 . . . . 0.0 110.846 169.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.4 m -72.06 -45.53 60.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.562 1.145 . . . . 0.0 111.246 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -72.66 -23.52 60.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.023 0.529 . . . . 0.0 111.02 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 127.325 2.25 . . . . 0.0 110.723 176.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.4 105.61 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.404 0.681 . . . . 0.0 109.47 162.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -131.19 132.03 44.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.797 1.639 . . . . 0.0 110.053 -175.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -104.62 95.84 6.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.5 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 mt -97.13 98.14 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 -171.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' GLU . 1.2 tt -62.95 101.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.476 1.11 . . . . 0.0 110.445 177.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.4 m -104.23 -177.59 3.41 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.4 0.28 . . . . 0.0 111.349 176.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.45 155.39 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 O-C-N 120.953 -1.092 . . . . 0.0 111.147 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.3 t -70.94 120.42 16.48 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.879 1.272 . . . . 0.0 108.982 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.0 t -57.42 -25.8 60.15 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.202 1.401 . . . . 0.0 113.402 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -90.29 -48.31 7.22 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.001 0.818 . . . . 0.0 111.176 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.7 p -113.92 0.9 14.55 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.797 0.839 . . . . 0.0 112.815 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.8 t70 58.77 21.11 8.59 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.787 2.035 . . . . 0.0 112.546 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.36 140.4 30.75 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -176.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -65.0 109.07 2.0 Allowed 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 127.155 2.182 . . . . 0.0 109.007 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.7 mm -96.75 151.69 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 162.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 13' ' ' LEU . 1.6 tt0 -134.59 115.9 14.39 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 120.009 -1.682 . . . . 0.0 108.379 161.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -79.37 85.66 5.16 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.2 m -71.56 74.75 0.79 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.369 0.986 . . . . 0.0 108.971 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.5 m -101.49 178.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 122.406 1.098 . . . . 0.0 109.317 -177.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.33 113.11 14.56 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 128.394 2.677 . . . . 0.0 104.434 172.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.7 m -157.77 125.18 5.16 Favored 'General case' 0 N--CA 1.437 -1.087 0 O-C-N 120.184 -1.572 . . . . 0.0 109.979 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -65.12 151.63 45.59 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.034 1.334 . . . . 0.0 110.267 -175.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -44.06 -49.12 8.9 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.316 1.447 . . . . 0.0 114.865 -170.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.33 -36.46 58.25 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 121.29 0.567 . . . . 0.0 110.973 -167.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -47.91 75.61 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.417 1.087 . . . . 0.0 109.599 168.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.12 -39.43 94.01 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 122.0 -0.438 . . . . 0.0 111.297 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -64.0 1.04 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 167.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.2 m -51.92 -44.16 63.73 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.869 0.759 . . . . 0.0 111.005 -170.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.19 -36.22 64.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.431 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.91 -34.09 76.69 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.199 175.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -32.34 66.56 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.626 0.648 . . . . 0.0 110.697 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.39 -49.4 77.07 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.083 0.856 . . . . 0.0 110.559 170.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.46 -42.15 98.33 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.514 0.597 . . . . 0.0 110.845 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 tp -59.85 -39.59 85.7 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.509 1.123 . . . . 0.0 111.401 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.8 t -72.98 -63.65 1.13 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.562 1.145 . . . . 0.0 111.501 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -160.19 -27.09 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -158.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 tp -70.67 156.96 38.81 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.443 1.019 . . . . 0.0 109.026 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -161.92 172.63 15.71 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 125.845 1.658 . . . . 0.0 106.647 170.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -116.04 178.07 4.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.128 0.971 . . . . 0.0 109.214 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.6 131.73 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -69.47 152.12 96.49 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -62.99 -26.31 74.02 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.18 1.92 . . . . 0.0 112.65 -176.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -59.62 -59.27 5.7 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.055 0.542 . . . . 0.0 109.872 169.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.8 m -60.28 -35.17 74.93 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.865 0.757 . . . . 0.0 112.204 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.96 96.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.857 0.753 . . . . 0.0 110.672 175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.2 m -75.24 -38.21 60.7 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.214 1.006 . . . . 0.0 111.555 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.86 -9.22 59.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.305 1.042 . . . . 0.0 111.915 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.414 10.4 pt20 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 128.953 2.901 . . . . 0.0 113.222 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 . . . . . 0 N--CA 1.426 -1.647 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 ttm-85 -63.12 92.95 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 N-CA-C 115.281 1.585 . . . . 0.0 115.281 -166.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.0 m170 -118.98 150.03 40.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.174 -1.376 . . . . 0.0 109.051 -173.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -123.57 83.91 2.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mt -90.24 97.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 tt -70.87 93.04 0.94 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 123.563 0.745 . . . . 0.0 110.016 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.4 t -81.1 171.75 14.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.145 0.978 . . . . 0.0 108.427 167.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.0 m -121.67 156.88 25.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.623 0.725 . . . . 0.0 109.571 164.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.0 t -76.88 108.22 9.77 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.218 1.407 . . . . 0.0 108.151 169.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.28 -4.66 0.88 Allowed 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -172.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -111.34 -16.87 13.27 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 120.354 1.434 . . . . 0.0 114.798 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 26.7 p -126.44 0.73 6.95 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.439 1.472 . . . . 0.0 113.952 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.1 t70 56.1 20.02 4.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.195 2.198 . . . . 0.0 112.864 -169.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.48 140.86 31.32 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 120.939 -1.101 . . . . 0.0 110.4 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 122.55 18.73 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.784 2.034 . . . . 0.0 109.724 -173.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.6 mt -124.06 99.01 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -82.7 92.6 7.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.064 0.546 . . . . 0.0 109.549 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -77.04 89.18 3.57 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -176.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.6 m -67.29 97.88 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.2 127.59 51.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 122.211 1.005 . . . . 0.0 110.204 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.88 92.35 7.77 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.7 p -132.68 142.99 49.34 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 127.313 2.245 . . . . 0.0 108.28 -158.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -83.53 -81.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 120.544 1.52 . . . . 0.0 112.393 -159.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -165.68 -61.42 0.03 OUTLIER 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.23 -40.89 70.8 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.038 1.335 . . . . 0.0 109.058 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -49.05 76.44 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.002 1.321 . . . . 0.0 109.953 171.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.57 -46.68 86.39 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.011 0.524 . . . . 0.0 110.185 178.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.72 -55.39 34.98 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.0 m -58.28 -47.84 82.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.494 -173.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -65.35 -35.15 80.09 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.329 0.513 . . . . 0.0 110.759 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.51 -43.42 98.89 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 175.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -61.71 -47.45 85.2 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.102 0.864 . . . . 0.0 109.413 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.73 -44.04 97.15 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.291 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -74.95 -24.49 58.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.489 0.716 . . . . 0.0 110.887 -175.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.46 -36.69 45.0 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.455 0.702 . . . . 0.0 111.047 169.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 t -69.01 -67.43 0.47 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.798 1.239 . . . . 0.0 111.662 -173.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.46 -41.36 0.09 Allowed 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -158.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 tp -69.68 150.01 47.44 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -143.78 167.23 22.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 124.003 0.921 . . . . 0.0 109.038 166.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -95.3 -30.35 14.0 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -162.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.4 t 61.21 113.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 127.853 2.461 . . . . 0.0 111.916 -175.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.0 p -66.36 153.56 92.44 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 120.949 -1.094 . . . . 0.0 110.343 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.13 -24.57 66.1 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 122.399 2.066 . . . . 0.0 112.704 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -58.76 -53.55 57.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.172 0.589 . . . . 0.0 110.402 170.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.1 m -66.82 -36.32 82.08 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.661 175.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.53 -28.98 67.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.1 1.318 . . . . 0.0 112.029 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.0 m -82.28 -43.97 16.86 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.53 1.132 . . . . 0.0 111.303 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.83 -40.47 22.45 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.553 0.741 . . . . 0.0 112.01 -172.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 . . . . . 0 C--O 1.256 1.397 1 C-N-CA 134.139 4.975 . . . . 0.0 112.07 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.297 0.9 OUTLIER . . . . . 0 N--CA 1.44 -0.929 0 CA-C-O 116.739 -1.6 . . . . 0.0 111.259 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -51.29 103.45 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.936 1.244 . . . . 0.0 111.637 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -125.93 138.18 53.75 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -119.63 82.49 1.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.772 0.829 . . . . 0.0 108.91 -173.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.5 mt -90.35 101.25 12.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 -171.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 tt -74.82 87.07 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.326 1.05 . . . . 0.0 110.068 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.8 t -80.02 -171.5 2.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.178 1.391 . . . . 0.0 108.846 159.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 m -139.67 164.93 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 121.153 -0.967 . . . . 0.0 111.177 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.87 112.91 5.18 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 166.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -58.51 -18.96 33.31 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.917 0.887 . . . . 0.0 113.34 -171.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -109.01 -14.75 14.49 Favored 'General case' 0 C--N 1.345 0.389 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -128.33 2.28 5.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.644 1.565 . . . . 0.0 114.054 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 57.72 20.32 6.32 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.234 1.814 . . . . 0.0 112.989 -174.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.45 150.85 52.09 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 121.082 -1.011 . . . . 0.0 110.633 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.407 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -66.51 112.01 3.88 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.705 2.002 . . . . 0.0 108.833 -172.61 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.0 mm -121.64 85.61 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 123.369 1.557 . . . . 0.0 108.05 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.82 121.24 15.04 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.443 159.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.1 mt -86.39 75.96 9.72 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 161.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.3 m -73.77 94.88 2.31 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 165.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.67 175.55 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.829 1.651 . . . . 0.0 108.45 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -120.47 119.87 34.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 162.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -143.25 169.01 18.43 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.639 1.176 . . . . 0.0 109.491 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 m -95.94 175.46 6.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 159.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.14 79.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.405 0.682 . . . . 0.0 111.958 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.09 -40.05 82.71 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.198 0.999 . . . . 0.0 110.764 -178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -63.51 -47.91 79.74 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.378 1.471 . . . . 0.0 109.404 173.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.83 -46.62 81.57 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.675 0.79 . . . . 0.0 109.962 175.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.0 ttt180 -59.88 -52.25 66.22 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.7 m -56.91 -52.23 65.98 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.241 1.016 . . . . 0.0 111.117 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.93 -31.49 72.69 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -63.16 -44.5 95.29 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 118.323 -0.846 . . . . 0.0 109.354 172.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.32 -46.1 89.51 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.523 1.056 . . . . 0.0 110.311 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -46.87 80.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.291 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -65.73 -26.59 67.81 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.795 0.685 . . . . 0.0 112.563 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -75.67 -33.87 60.43 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.317 1.847 . . . . 0.0 111.168 172.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -75.68 -67.37 0.67 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.112 0.965 . . . . 0.0 111.23 -172.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -157.76 -36.38 0.07 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.851 1.261 . . . . 0.0 112.515 -158.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.21 154.01 40.96 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.8 p -144.3 168.37 20.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.536 1.134 . . . . 0.0 108.189 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -91.5 -57.02 2.9 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 123.328 0.393 . . . . 0.0 110.665 -176.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t 67.85 134.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.714 2.406 . . . . 0.0 110.338 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.8 p -71.44 149.55 93.76 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.686 -1.259 . . . . 0.0 109.164 174.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.12 -25.48 65.67 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.316 2.01 . . . . 0.0 113.087 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -66.61 -37.92 85.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.936 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.3 m -76.29 -27.35 56.6 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 112.024 170.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.66 74.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.957 1.708 . . . . 0.0 110.718 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.2 m -76.63 -62.5 1.61 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.139 0.976 . . . . 0.0 111.219 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -83.9 -23.71 31.1 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -167.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 . . . . . 0 C--O 1.246 0.877 0 C-N-CA 128.402 2.681 . . . . 0.0 113.449 177.822 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 . . . . . 0 CA--C 1.539 0.55 0 CA-C-O 123.156 1.455 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.59 108.04 0.21 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 126.539 1.936 . . . . 0.0 110.804 166.023 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -125.97 166.37 17.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 125.097 1.359 . . . . 0.0 110.303 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.46 89.27 3.01 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.7 mt -78.98 94.65 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.24 103.31 1.55 Allowed 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 121.221 -0.925 . . . . 0.0 109.255 170.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t -104.71 179.01 4.4 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.897 0.879 . . . . 0.0 108.865 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.1 m -134.25 153.94 36.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-O 121.747 0.784 . . . . 0.0 111.027 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 21' ' ' GLY . 42.6 t -73.88 115.13 12.96 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.359 1.464 . . . . 0.0 109.818 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 t -59.7 -13.34 9.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.551 1.54 . . . . 0.0 113.905 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -115.7 -11.24 11.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.7 p -136.09 1.86 2.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.943 1.701 . . . . 0.0 114.855 174.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 55.55 20.79 4.0 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 127.477 2.311 . . . . 0.0 113.5 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.428 ' H ' ' HB3' ' A' ' 16' ' ' CYS . . . -71.92 140.88 30.8 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 120.823 -1.173 . . . . 0.0 110.265 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -69.43 123.46 21.29 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.673 1.989 . . . . 0.0 109.391 -175.466 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.5 mp -119.61 106.49 19.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 164.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.474 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 41.2 tt0 -81.38 90.42 6.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.5 mt -70.2 86.42 0.57 Allowed 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.4 m -70.09 101.37 1.81 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.2 m -136.61 139.58 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.091 0.956 . . . . 0.0 108.617 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.5 mp0 -95.58 91.27 6.06 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.23 -2.137 . . . . 0.0 105.23 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.1 p -132.65 120.26 21.51 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 124.57 1.148 . . . . 0.0 109.872 -166.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -57.81 148.13 26.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.72 1.263 . . . . 0.0 109.452 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -50.9 -40.59 57.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.869 0.867 . . . . 0.0 113.042 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.9 -45.32 82.41 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.342 1.057 . . . . 0.0 111.764 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.75 -54.85 41.46 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tt -52.43 -48.63 65.64 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.039 0.936 . . . . 0.0 110.584 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -57.05 -48.09 79.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.679 0.791 . . . . 0.0 109.695 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -56.45 -50.12 72.62 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.604 0.762 . . . . 0.0 110.43 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.46 -43.7 71.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -67.5 -36.29 80.79 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.318 -169.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -62.04 -46.51 88.82 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 123.748 0.819 . . . . 0.0 109.634 173.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.03 -52.43 63.99 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 118.416 -0.802 . . . . 0.0 110.59 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -64.17 -29.23 70.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -70.67 -41.43 72.06 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.087 0.955 . . . . 0.0 111.251 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -70.15 -68.04 0.45 Allowed 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.727 1.611 . . . . 0.0 111.422 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -155.08 -34.19 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -158.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.1 tp -71.0 165.92 22.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.86 0.838 . . . . 0.0 109.154 175.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.5 m -159.38 -175.04 4.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -118.62 169.37 9.87 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.16 0.984 . . . . 0.0 108.712 -176.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.9 p -144.97 132.33 16.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.4 p -70.41 154.45 94.45 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.911 -0.566 . . . . 0.0 109.933 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -63.7 -31.59 69.19 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.243 1.962 . . . . 0.0 112.719 -174.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -56.55 -49.92 73.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.745 0.818 . . . . 0.0 110.397 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 m -68.86 -31.19 69.97 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.167 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.14 71.04 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.093 1.315 . . . . 0.0 111.513 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.99 -16.62 18.65 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -108.84 -31.25 7.76 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.562 1.073 . . . . 0.0 111.964 176.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.27 69.1 mt-30 . . . . . 0 C--O 1.255 1.361 0 C-N-CA 129.787 3.235 . . . . 0.0 115.883 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.21 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 t -150.94 176.55 11.0 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -134.99 110.69 9.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.791 1.237 . . . . 0.0 108.178 -171.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 tpp -153.13 98.67 2.31 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.483 ' H ' ' CD ' ' A' ' 6' ' ' GLU . . . -146.26 23.7 1.31 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.215 1.806 . . . . 0.0 114.238 -164.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' A' ' 5' ' ' ALA . 25.1 mp0 -86.13 156.88 57.28 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 122.795 0.438 . . . . 0.0 110.683 -161.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -65.76 169.82 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.283 1.989 . . . . 0.0 109.955 170.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 55.4 -67.52 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 127.96 2.504 . . . . 0.0 112.686 -164.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -54.05 89.17 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -128.97 133.23 47.72 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.662 1.185 . . . . 0.0 108.748 -168.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.48 94.89 5.57 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.261 1.024 . . . . 0.0 109.327 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.3 mt -96.41 98.66 7.91 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.727 HD13 ' HD2' ' A' ' 22' ' ' ARG 0.391 0.2 OUTLIER -84.1 124.33 31.0 Favored 'General case' 0 N--CA 1.439 -0.99 0 O-C-N 120.816 -1.177 . . . . 0.0 111.688 -177.987 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.1 t -120.5 -154.94 0.6 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.284 2.234 . . . . 0.0 108.055 172.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.439 ' CG1' HH21 ' A' ' 22' ' ' ARG . 13.4 m -137.17 159.97 36.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 O-C-N 120.502 -1.374 . . . . 0.0 111.22 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.2 t -66.02 110.97 3.13 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -56.91 -11.51 1.5 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.617 1.967 . . . . 0.0 114.232 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -121.21 -14.66 8.31 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -175.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -125.66 2.79 7.53 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.08 1.309 . . . . 0.0 113.778 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.3 t70 58.13 15.91 3.55 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.861 2.464 . . . . 0.0 113.678 -177.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.06 146.83 28.35 Favored Glycine 0 C--N 1.342 0.871 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -174.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.727 ' HD2' HD13 ' A' ' 13' ' ' LEU . 1.8 tpp85 -70.92 119.14 14.61 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 124.548 1.139 . . . . 0.0 110.573 -166.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 78.6 mt -109.26 100.11 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 169.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.29 97.18 1.53 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 163.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.69 82.92 0.87 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.0 m -69.97 102.17 1.95 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -118.55 172.94 5.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 C-N-CA 124.676 1.19 . . . . 0.0 108.619 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -120.98 92.91 3.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 165.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -133.31 131.08 39.74 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.789 0.835 . . . . 0.0 109.118 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 m -62.53 162.21 10.73 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.4 62.41 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 122.904 0.482 . . . . 0.0 112.254 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -75.19 -33.98 61.49 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -174.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -67.09 -45.66 76.6 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.37 0.668 . . . . 0.0 109.421 171.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.97 -44.0 86.81 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.567 0.747 . . . . 0.0 110.158 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.79 -53.43 54.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.807 1.243 . . . . 0.0 109.392 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.6 m -59.05 -51.13 71.38 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.788 0.835 . . . . 0.0 109.984 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.16 -28.46 68.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.582 -0.723 . . . . 0.0 110.583 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -50.87 69.38 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 118.826 0.739 . . . . 0.0 109.326 170.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -62.54 -41.05 98.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -175.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.91 -49.13 77.42 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.172 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.36 -34.07 77.13 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.352 0.524 . . . . 0.0 111.635 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.0 tt -66.61 -38.67 87.45 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.191 0.996 . . . . 0.0 110.816 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.8 t -70.88 -67.57 0.5 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.331 1.452 . . . . 0.0 111.452 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -153.89 -36.63 0.1 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -158.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 tp -66.12 148.0 52.48 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.524 0.678 . . . . 0.0 109.604 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.8 m -160.5 168.14 25.72 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -121.02 174.02 6.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.853 1.661 . . . . 0.0 107.881 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.0 m -133.22 148.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 C-N-CA 126.588 1.955 . . . . 0.0 108.164 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.6 p -75.28 157.04 85.32 Favored Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -64.2 -27.0 64.45 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.188 1.925 . . . . 0.0 113.128 -174.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 43.0 t90 -58.5 -59.88 4.68 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.008 0.523 . . . . 0.0 109.767 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.2 m -58.77 -42.86 89.96 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.799 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.44 68.43 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.137 0.881 . . . . 0.0 112.409 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.1 m -79.68 -35.98 38.36 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.806 0.843 . . . . 0.0 111.241 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.77 -49.19 10.7 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 118.591 -0.719 . . . . 0.0 111.418 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 . . . . . 0 C--O 1.25 1.109 1 C-N-CA 133.966 4.907 . . . . 0.0 108.961 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.119 0 N-CA-C 107.563 -2.215 . . . . 0.0 107.563 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 t -65.23 161.27 19.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 118.375 -1.33 . . . . 0.0 107.531 137.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -144.28 97.8 3.1 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 125.167 1.387 . . . . 0.0 107.792 -175.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.8 ttp -149.9 34.93 0.68 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.136 1.374 . . . . 0.0 109.251 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -133.71 26.65 4.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.571 2.348 . . . . 0.0 110.726 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -134.81 153.96 79.07 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 126.855 2.062 . . . . 0.0 108.003 -172.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.89 51.28 3.03 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.247 3.298 . . . . 0.0 110.751 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -136.34 -76.26 0.43 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.926 1.69 . . . . 0.0 108.742 -169.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.67 101.31 0.07 Allowed 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.229 1.412 . . . . 0.0 111.532 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -126.38 152.18 46.65 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.333 1.453 . . . . 0.0 109.125 -173.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -125.51 96.35 4.77 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.0 mt -97.31 97.76 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -171.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.88 102.34 0.77 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 p -98.9 -172.27 2.26 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 162.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -130.7 151.69 36.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 121.779 0.8 . . . . 0.0 110.565 174.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -70.27 106.38 3.32 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.283 1.833 . . . . 0.0 108.335 162.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -59.9 -8.73 2.38 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 114.141 -174.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -114.1 -14.74 12.34 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.9 p -122.09 -0.82 9.38 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.005 1.275 . . . . 0.0 113.307 170.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.8 t0 50.97 23.33 1.44 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.514 2.325 . . . . 0.0 112.782 -169.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.63 137.46 18.16 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -76.42 139.12 40.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.231 -0.984 . . . . 0.0 109.807 -170.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.0 mt -130.42 98.62 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -72.8 87.89 1.3 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.502 1.521 . . . . 0.0 109.552 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.0 mt -70.22 86.68 0.58 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.845 0.858 . . . . 0.0 108.79 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.3 m -72.2 105.25 3.93 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 169.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.6 m -124.28 173.49 10.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 125.365 1.466 . . . . 0.0 109.204 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -125.11 99.76 6.25 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -157.95 130.26 7.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.693 -1.255 . . . . 0.0 108.634 -164.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 m -65.67 165.77 11.93 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -158.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.0 46.89 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.193 1.397 . . . . 0.0 113.635 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.14 -50.84 62.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -54.56 -44.79 73.23 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.874 0.87 . . . . 0.0 110.543 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.48 -48.68 76.61 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.259 0.624 . . . . 0.0 110.662 174.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.15 -53.93 48.35 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 m -58.97 -49.87 76.24 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 124.162 0.985 . . . . 0.0 110.467 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.91 -32.72 74.56 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.32 0.964 . . . . 0.0 111.493 176.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -57.86 -45.84 85.7 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 173.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -60.19 -42.05 94.21 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 118.909 0.777 . . . . 0.0 110.364 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.9 mt -59.48 -49.96 75.75 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.109 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -65.97 -33.36 75.64 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.174 0.443 . . . . 0.0 111.61 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.26 -38.59 90.79 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.829 0.74 . . . . 0.0 111.391 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 t -74.31 -58.94 2.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.63 1.172 . . . . 0.0 111.168 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.1 m -163.37 -23.24 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.45 142.97 58.24 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 120.074 1.307 . . . . 0.0 110.056 -173.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.3 m -155.79 166.72 32.64 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 165.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -119.77 -172.88 2.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -165.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.52 126.86 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.4 p -68.73 150.32 97.67 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.93 -28.66 66.87 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.143 1.895 . . . . 0.0 113.523 -169.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -61.44 -49.82 75.29 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.808 0.443 . . . . 0.0 110.792 171.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.6 m -68.15 -32.78 73.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.842 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.01 -32.08 73.63 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 120.012 1.278 . . . . 0.0 111.437 173.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.8 m -76.48 -49.74 15.81 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.428 1.091 . . . . 0.0 110.928 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -85.69 -16.72 38.14 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.767 0.827 . . . . 0.0 112.544 -173.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 131.038 3.735 . . . . 0.0 114.956 -177.985 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.277 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.5 t 59.48 14.25 3.74 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -135.44 76.78 1.64 Allowed 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 175.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.7 ptm -174.4 175.45 2.59 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 127.759 2.424 . . . . 0.0 106.766 -166.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.87 24.15 13.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.522 1.529 . . . . 0.0 114.223 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -78.5 161.31 70.23 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.237 -167.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -64.1 169.18 11.01 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.053 1.836 . . . . 0.0 110.28 165.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.258 0.1 OUTLIER 64.64 -73.56 0.05 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.184 1.794 . . . . 0.0 111.22 -170.545 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -53.3 92.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.478 2.311 . . . . 0.0 112.586 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -126.47 160.92 29.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.138 0.975 . . . . 0.0 110.167 -175.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -133.45 98.09 4.13 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.275 -0.89 . . . . 0.0 110.254 -168.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.2 mm -86.95 100.22 9.51 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.519 HD21 ' HD3' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -66.83 86.75 0.13 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.108 0.963 . . . . 0.0 109.68 173.756 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.4 t -89.26 176.73 6.83 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.332 1.453 . . . . 0.0 110.018 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -123.75 158.48 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.322 1.049 . . . . 0.0 110.318 163.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -73.99 115.16 13.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.637 1.975 . . . . 0.0 109.351 169.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.5 t -55.95 -24.44 38.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.066 1.746 . . . . 0.0 113.977 -173.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.44 -41.87 9.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.88 1.218 . . . . 0.0 112.723 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -110.93 -3.64 15.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.7 t0 49.8 38.53 15.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.691 1.996 . . . . 0.0 112.054 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.2 144.86 17.37 Favored Glycine 0 C--N 1.341 0.829 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 170.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.519 ' HD3' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -81.5 149.62 28.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.909 -165.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.94 108.46 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -80.31 91.9 5.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.791 0.836 . . . . 0.0 108.762 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -74.81 87.16 2.24 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -176.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -71.45 95.68 1.4 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 171.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -104.62 172.57 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.383 1.473 . . . . 0.0 109.503 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -123.57 107.47 11.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.217 -1.771 . . . . 0.0 106.217 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.3 t -151.17 169.19 22.48 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.998 0.519 . . . . 0.0 109.808 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.6 m -82.34 170.28 15.52 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.555 -1.341 . . . . 0.0 110.643 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.03 74.42 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.186 0.594 . . . . 0.0 111.285 -174.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 32' ' ' GLU . 1.7 mp0 -62.3 -52.73 62.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.76 2.024 . . . . 0.0 109.918 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.88 -46.74 77.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.486 1.114 . . . . 0.0 109.818 177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.96 -47.19 68.32 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.119 0.418 . . . . 0.0 111.065 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -64.72 -49.65 70.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.4 m -58.69 -50.12 75.04 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.445 0.298 . . . . 0.0 110.365 -176.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.89 -31.94 72.87 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.875 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.23 -41.97 89.92 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 119.611 1.096 . . . . 0.0 108.724 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -63.67 -43.6 96.22 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-N 119.264 0.938 . . . . 0.0 110.313 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.42 -42.7 99.15 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.261 0.482 . . . . 0.0 112.002 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -73.89 -30.82 62.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.788 0.435 . . . . 0.0 111.231 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.3 mt -69.44 -35.61 75.85 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.923 0.783 . . . . 0.0 111.131 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.3 t -67.58 -68.9 0.35 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.461 1.505 . . . . 0.0 110.935 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -36.65 0.1 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -158.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.14 153.0 43.67 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.481 0.658 . . . . 0.0 109.76 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.5 m -165.79 167.87 16.54 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 126.017 1.727 . . . . 0.0 107.126 170.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -115.97 -179.72 3.74 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.214 1.405 . . . . 0.0 108.854 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -134.48 132.66 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 126.766 2.027 . . . . 0.0 105.856 -178.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.1 p -70.14 151.52 95.96 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -62.03 -30.95 83.64 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.929 1.752 . . . . 0.0 112.125 -175.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -56.89 -48.68 77.63 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.287 0.494 . . . . 0.0 111.066 171.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.1 m -69.69 -28.32 65.74 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.278 -0.867 . . . . 0.0 112.413 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.65 81.59 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.378 0.99 . . . . 0.0 110.213 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.8 m -65.55 -47.94 74.13 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.868 0.867 . . . . 0.0 112.006 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.62 -24.0 59.97 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.276 0.489 . . . . 0.0 111.669 -176.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 127.596 2.358 . . . . 0.0 112.621 170.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.107 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 t 57.2 -169.67 0.1 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.895 0.878 . . . . 0.0 111.419 -165.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -148.56 -176.87 5.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 128.72 2.808 . . . . 0.0 107.826 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 39.1 tpp -132.14 155.44 48.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.653 1.181 . . . . 0.0 108.574 173.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.32 69.2 10.7 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.592 1.557 . . . . 0.0 109.14 171.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' CD ' HH21 ' A' ' 9' ' ' ARG . 14.9 mt-10 -72.94 138.87 79.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 118.849 -0.596 . . . . 0.0 110.682 -168.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -79.11 37.9 0.69 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.159 3.906 . . . . 0.0 111.468 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -140.39 -72.33 0.36 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.831 2.052 . . . . 0.0 107.576 -176.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.417 HH21 ' CD ' ' A' ' 6' ' ' GLU . 26.3 ttm-85 -64.59 101.68 0.48 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.656 1.582 . . . . 0.0 112.73 -172.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -135.48 109.98 8.52 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.152 -1.386 . . . . 0.0 109.989 -159.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -87.11 110.89 20.42 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.91 1.284 . . . . 0.0 108.837 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.0 mt -112.08 98.47 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.87 110.72 2.97 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.218 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.9 t -109.65 -179.21 3.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.407 0.683 . . . . 0.0 109.98 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.3 m -136.95 153.29 29.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 122.051 0.929 . . . . 0.0 112.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 48' ' ' VAL . 45.4 t -65.38 119.37 10.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.675 163.287 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.4 t -56.52 -18.67 12.36 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.29 1.436 . . . . 0.0 114.657 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HE3' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -125.28 -16.92 5.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -164.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.9 p -121.71 0.63 9.87 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.816 0.846 . . . . 0.0 113.072 169.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.59 19.85 4.52 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.302 1.841 . . . . 0.0 112.647 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.0 131.46 36.41 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -71.88 114.67 10.22 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 127.286 2.234 . . . . 0.0 109.621 -169.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.1 mm -110.15 134.57 51.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -105.91 93.28 4.55 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 174.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -79.68 82.49 5.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . 0.339 5.7 t -73.62 103.52 4.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 117.514 -1.674 . . . . 0.0 108.674 161.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.73 172.02 1.19 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 158.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.61 93.71 3.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 160.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.2 t -158.05 171.73 19.71 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.67 0.388 . . . . 0.0 111.256 -167.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.1 t -68.47 166.7 16.32 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.852 0.834 . . . . 0.0 111.678 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.72 72.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.951 1.3 . . . . 0.0 111.369 167.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -68.14 -48.79 64.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.025 0.93 . . . . 0.0 110.057 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -67.94 -46.27 71.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.802 1.241 . . . . 0.0 109.865 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tt -48.91 -51.61 29.09 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 118.348 0.522 . . . . 0.0 110.271 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -59.93 -55.86 28.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 m -53.17 -53.04 56.34 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.193 0.997 . . . . 0.0 110.063 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -34.85 79.21 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.058 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.47 -46.86 88.53 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 117.185 -1.388 . . . . 0.0 109.476 170.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -46.36 82.35 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 121.128 1.785 . . . . 0.0 109.862 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -70.45 -43.63 69.47 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.428 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -67.44 -23.36 65.51 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.35 -34.18 48.58 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.262 1.825 . . . . 0.0 110.844 171.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.3 t -66.75 -67.54 0.44 Allowed 'General case' 0 C--N 1.339 0.152 0 C-N-CA 124.302 1.041 . . . . 0.0 110.287 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -44.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.775 0.83 . . . . 0.0 112.384 -158.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.01 139.09 55.25 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -144.96 161.98 38.03 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -172.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -118.31 68.75 0.78 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 117.963 0.347 . . . . 0.0 110.919 -158.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.408 ' HA ' ' SG ' ' A' ' 16' ' ' CYS . 35.7 m -62.33 113.19 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-O 121.64 0.733 . . . . 0.0 109.671 -177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.1 p -57.97 152.96 36.24 Favored Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 124.21 1.004 . . . . 0.0 110.317 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -63.72 -25.87 68.53 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.303 2.002 . . . . 0.0 113.096 -171.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.3 t90 -60.79 -53.32 58.81 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.292 0.497 . . . . 0.0 109.848 169.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.409 ' SG ' ' HE3' ' A' ' 18' ' ' LYS . 10.0 m -62.62 -36.74 83.76 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.919 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.5 88.61 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.597 0.635 . . . . 0.0 111.296 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 m -74.06 -42.06 60.8 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.306 1.042 . . . . 0.0 111.402 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -86.67 -19.86 28.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.436 0.694 . . . . 0.0 112.336 -172.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.549 2.34 . . . . 0.0 111.156 -173.095 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.203 0 N-CA-C 110.146 -1.181 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.8 t -138.55 20.54 2.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.791 0.836 . . . . 0.0 112.048 -176.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -136.89 172.92 12.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 167.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.9 ttm -66.05 161.34 21.85 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.329 1.452 . . . . 0.0 110.904 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.29 92.84 9.31 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 159.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -83.41 143.79 45.24 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.346 -159.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -78.82 46.5 2.19 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.144 3.896 . . . . 0.0 111.186 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -152.49 -66.74 0.16 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -55.0 93.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 127.522 2.329 . . . . 0.0 111.478 172.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.6 m170 -125.29 143.97 50.7 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.888 1.275 . . . . 0.0 110.451 -168.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.57 82.19 1.68 Allowed 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.118 0.567 . . . . 0.0 109.711 -176.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.82 100.91 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -72.56 100.06 2.67 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 120.928 -1.107 . . . . 0.0 109.778 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.45 -173.94 4.77 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 160.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.45 159.41 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.641 1.176 . . . . 0.0 110.01 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.27 113.28 9.14 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.769 2.028 . . . . 0.0 108.558 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.4 t -56.9 -18.65 14.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.17 1.788 . . . . 0.0 113.458 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.32 -16.19 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.0 p -129.9 -0.8 4.75 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.749 1.613 . . . . 0.0 114.475 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 55.1 24.06 5.8 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.556 1.943 . . . . 0.0 113.217 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.56 146.37 28.61 Favored Glycine 0 C--N 1.34 0.78 0 N-CA-C 108.714 -1.754 . . . . 0.0 108.714 175.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.79 141.12 39.42 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.613 -166.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mm -121.93 94.09 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -74.25 95.46 2.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.321 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.94 74.06 5.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.3 m -75.39 96.65 3.46 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 167.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.92 157.48 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 C-N-CA 126.143 1.777 . . . . 0.0 108.589 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -104.82 102.59 12.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 -178.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -151.97 156.73 40.61 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 118.057 0.39 . . . . 0.0 110.283 173.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 163.33 21.72 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.234 0.614 . . . . 0.0 111.928 -174.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.61 -34.89 74.91 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.643 0.777 . . . . 0.0 111.329 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.65 -48.92 78.65 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.323 1.849 . . . . 0.0 110.547 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -69.18 -46.99 66.13 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.949 0.9 . . . . 0.0 109.857 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -50.12 -46.14 53.51 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.285 0.634 . . . . 0.0 110.881 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -66.22 -51.79 54.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.8 0.84 . . . . 0.0 109.416 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.6 m -58.05 -51.99 67.39 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.997 0.919 . . . . 0.0 110.078 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.67 -31.44 72.66 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.138 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.39 -51.68 61.78 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.296 0.953 . . . . 0.0 108.871 170.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -59.65 -43.77 93.79 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.31 -47.2 86.28 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.164 0.438 . . . . 0.0 112.053 177.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -71.86 -25.74 62.07 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.034 0.534 . . . . 0.0 112.315 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.97 -43.26 75.33 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.389 0.995 . . . . 0.0 110.561 166.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.7 t -66.85 -54.89 17.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.747 1.219 . . . . 0.0 111.22 -172.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 83.2 m -160.25 -27.18 0.06 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 156.78 38.14 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 120.027 1.285 . . . . 0.0 110.685 -171.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.1 m -164.96 171.24 14.26 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.744 1.617 . . . . 0.0 108.35 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -128.38 -179.95 5.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.738 1.215 . . . . 0.0 109.425 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.3 p -147.07 136.83 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.613 1.565 . . . . 0.0 107.146 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.6 p -72.78 154.58 91.17 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.147 -0.454 . . . . 0.0 109.947 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.9 -27.54 58.78 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.34 2.027 . . . . 0.0 112.819 -177.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -58.25 -57.62 12.07 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.063 0.545 . . . . 0.0 109.54 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 m -59.76 -39.5 85.04 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.633 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.537 1.062 . . . . 0.0 111.4 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -76.82 -31.83 57.19 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.455 1.102 . . . . 0.0 111.782 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.98 -6.71 41.75 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.272 1.029 . . . . 0.0 112.705 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.322 14.8 pt20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 129.581 3.152 . . . . 0.0 113.856 -171.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.281 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 58.6 13.89 2.81 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -87.77 153.95 20.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.013 0.925 . . . . 0.0 109.121 172.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 21.7 ttt -147.79 148.93 31.46 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 167.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 121.92 28.21 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 1 C-N-CA 131.937 4.095 . . . . 0.0 111.317 -170.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.68 143.08 50.09 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 123.672 0.789 . . . . 0.0 110.838 -158.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.8 103.6 1.19 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.43 2.753 . . . . 0.0 111.439 -163.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 42.64 58.25 3.2 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.644 1.978 . . . . 0.0 113.483 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -66.12 88.48 0.12 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 110.743 -2.935 . . . . 0.0 108.246 167.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.8 m170 -105.26 173.61 6.23 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.564 1.946 . . . . 0.0 110.683 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.22 93.72 3.64 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 125.345 1.458 . . . . 0.0 107.77 175.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 mt -95.09 100.31 10.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -173.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.8 tt -66.69 112.06 4.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.763 0.825 . . . . 0.0 109.453 175.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 p -108.54 -169.91 1.58 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.125 0.57 . . . . 0.0 110.35 160.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -125.08 165.75 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 122.94 0.496 . . . . 0.0 109.85 165.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.5 t -68.16 124.19 22.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.123 1.369 . . . . 0.0 107.653 160.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.87 -7.05 6.98 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -172.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -137.72 -8.68 1.64 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.6 p -128.75 1.58 5.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.883 1.273 . . . . 0.0 110.469 167.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.73 29.55 9.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.301 2.64 . . . . 0.0 112.49 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.49 141.95 25.32 Favored Glycine 0 C--N 1.339 0.701 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -71.51 120.7 17.46 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 126.766 2.026 . . . . 0.0 110.586 -170.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.53 106.98 18.58 Favored 'Isoleucine or valine' 0 C--N 1.346 0.428 0 CA-C-N 119.928 1.24 . . . . 0.0 108.175 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -79.86 92.46 5.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.832 0.853 . . . . 0.0 109.362 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.4 mt -69.45 90.18 0.52 Allowed 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.1 m -74.88 100.37 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.72 154.2 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 124.421 1.089 . . . . 0.0 109.325 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -113.8 110.11 19.62 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.2 m -155.15 112.6 3.35 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -160.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.4 m -71.13 156.48 39.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.978 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.96 -38.48 62.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -166.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.95 -56.2 9.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.722 1.209 . . . . 0.0 110.664 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -56.97 -38.04 72.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.355 1.862 . . . . 0.0 111.402 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.22 -42.95 96.37 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.381 1.472 . . . . 0.0 109.174 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.92 -42.51 98.25 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.314 0.646 . . . . 0.0 110.367 173.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.6 m -60.96 -54.47 44.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.757 0.708 . . . . 0.0 110.196 175.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.42 -29.64 68.35 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.989 0.813 . . . . 0.0 111.891 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -55.74 -51.4 67.49 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 125.72 1.608 . . . . 0.0 108.183 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -70.63 -33.38 70.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.013 0.525 . . . . 0.0 111.102 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.13 -50.48 71.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.53 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -62.94 -34.63 77.88 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.801 0.728 . . . . 0.0 111.446 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 tt -68.62 -37.78 80.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 0.0 110.711 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 t -70.83 -69.34 0.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.575 1.55 . . . . 0.0 111.796 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -154.9 -32.08 0.1 Allowed 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -158.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.7 tp -64.09 129.12 38.73 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.355 0.662 . . . . 0.0 109.531 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -133.87 166.5 22.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 168.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -122.89 167.45 13.54 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.271 1.428 . . . . 0.0 107.961 -174.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.2 t -140.13 132.67 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -174.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.8 p -69.31 153.43 95.9 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.6 -28.93 69.87 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.096 1.864 . . . . 0.0 113.086 -172.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -59.72 -60.31 4.04 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.521 0.601 . . . . 0.0 109.71 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.5 m -54.96 -43.8 73.8 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.902 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.57 74.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.812 0.733 . . . . 0.0 111.997 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.37 -25.15 39.32 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.345 1.058 . . . . 0.0 112.007 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -104.75 -12.27 16.41 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.614 0.765 . . . . 0.0 112.841 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 116.925 -1.512 . . . . 0.0 112.869 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.272 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t 54.2 37.48 27.29 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.074 0.95 . . . . 0.0 112.583 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -71.26 77.12 0.72 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.762 1.225 . . . . 0.0 110.195 -178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 46.6 tpp -139.43 114.11 9.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.319 1.047 . . . . 0.0 109.599 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -148.32 140.24 23.91 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 159.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -131.32 156.58 79.93 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.613 0.765 . . . . 0.0 109.105 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -70.43 164.16 36.21 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 N-CA-C 107.567 -1.743 . . . . 0.0 107.567 158.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 58.11 -61.45 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.912 0 C-N-CA 128.317 2.647 . . . . 0.0 112.89 -172.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 110.16 0.7 Allowed 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 121.227 1.83 . . . . 0.0 110.739 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.44 164.8 28.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.524 -1.216 . . . . 0.0 108.721 -176.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.16 117.11 17.07 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -114.79 100.75 11.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.9 tp -72.05 86.24 1.03 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.609 1.964 . . . . 0.0 110.152 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -90.12 -171.66 3.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.458 0.703 . . . . 0.0 109.422 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.93 154.2 39.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 123.181 0.592 . . . . 0.0 110.526 170.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.86 106.47 2.3 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.717 1.207 . . . . 0.0 107.792 162.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.19 -3.18 0.79 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -172.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.65 -16.94 11.23 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 30.5 p -120.05 2.41 10.95 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.117 1.326 . . . . 0.0 112.688 170.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.2 t0 54.21 21.35 3.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.436 2.294 . . . . 0.0 112.578 -171.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.42 129.15 16.73 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -55.32 113.1 1.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 129.254 3.022 . . . . 0.0 108.681 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.251 0.6 OUTLIER -126.55 106.49 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 122.679 1.228 . . . . 0.0 109.327 -172.387 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -87.5 94.26 9.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.254 1.021 . . . . 0.0 109.097 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.65 87.04 1.65 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.9 m -71.79 101.79 2.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 170.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.9 m -107.33 170.41 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.046 1.338 . . . . 0.0 108.463 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -134.25 83.7 2.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 168.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.7 t -154.96 156.7 36.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.712 0.805 . . . . 0.0 109.498 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -72.38 166.28 22.85 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.717 0.807 . . . . 0.0 112.037 -172.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.07 -39.92 63.66 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.077 1.351 . . . . 0.0 113.708 -172.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.43 -42.08 88.22 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.93 0.892 . . . . 0.0 111.369 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -74.07 -41.45 61.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.749 0.82 . . . . 0.0 110.124 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.18 -50.48 49.16 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.287 0.635 . . . . 0.0 110.46 167.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.0 ttt-85 -64.63 -41.95 95.82 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 124.418 1.087 . . . . 0.0 110.628 -177.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 m -63.08 -53.81 47.76 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.817 0.447 . . . . 0.0 110.66 176.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.63 -30.85 69.66 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.144 0.577 . . . . 0.0 110.844 -174.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.13 -59.79 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.262 1.425 . . . . 0.0 108.098 164.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -59.94 -35.72 75.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 117.083 -1.437 . . . . 0.0 111.705 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -46.99 68.63 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.278 1.399 . . . . 0.0 113.903 167.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -67.1 -1.53 4.38 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -114.88 -27.91 7.24 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 126.356 1.862 . . . . 0.0 108.478 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.3 p -77.05 -52.31 9.54 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.257 0.551 . . . . 0.0 111.175 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -157.11 -39.93 0.07 Allowed 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.845 1.258 . . . . 0.0 113.007 -158.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.62 163.17 23.84 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.266 0.555 . . . . 0.0 110.198 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -144.69 170.45 16.07 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 168.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -91.1 -30.18 16.88 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.064 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.4 t 57.48 104.72 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 127.263 2.225 . . . . 0.0 111.942 -175.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.03 150.0 31.91 Favored Pre-proline 0 CA--C 1.537 0.472 0 O-C-N 121.352 -0.842 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.43 -25.72 63.27 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.27 1.98 . . . . 0.0 113.053 -172.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.99 -49.79 76.28 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 169.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 41.7 m -67.6 -34.06 76.25 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.828 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.48 67.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.998 1.272 . . . . 0.0 111.814 174.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -86.08 -52.56 5.61 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.881 1.272 . . . . 0.0 111.043 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -83.6 -18.4 38.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.373 1.069 . . . . 0.0 112.526 -171.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 . . . . . 0 C--O 1.248 0.991 0 C-N-CA 129.752 3.221 . . . . 0.0 113.606 171.646 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.416 ' H1 ' ' CD ' ' A' ' 6' ' ' GLU . . . . . . . . 0 N--CA 1.471 0.993 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.9 t -165.55 -141.21 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.117 2.567 . . . . 0.0 104.933 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -62.46 -0.12 0.55 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.993 1.317 . . . . 0.0 113.394 164.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 50.1 ttm -132.16 145.36 51.31 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.285 2.234 . . . . 0.0 106.095 165.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -128.88 163.16 25.85 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.434 1.094 . . . . 0.0 108.857 170.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' CD ' ' H1 ' ' A' ' 1' ' ' GLY . 1.0 OUTLIER -126.37 152.42 73.94 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.874 1.67 . . . . 0.0 110.379 -166.533 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -82.08 50.46 3.46 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.909 3.073 . . . . 0.0 110.888 -170.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -148.58 -69.78 0.22 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.522 -0.736 . . . . 0.0 109.856 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -52.74 100.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.657 1.583 . . . . 0.0 111.177 173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -130.13 153.43 48.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.878 1.271 . . . . 0.0 109.546 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -121.88 118.05 27.99 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.978 0.911 . . . . 0.0 108.653 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.5 mt -117.73 101.12 11.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.38 105.38 3.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.314 -0.867 . . . . 0.0 109.323 172.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.0 t -102.52 -179.76 4.07 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.406 1.082 . . . . 0.0 108.387 169.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -131.5 156.46 42.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.828 0.823 . . . . 0.0 109.292 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.31 99.71 2.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 162.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -58.78 -2.05 0.2 Allowed 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.194 1.554 . . . . 0.0 115.194 -173.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -114.69 -14.3 12.03 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.049 1.34 . . . . 0.0 114.449 177.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.4 p -126.08 1.32 7.22 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.565 1.529 . . . . 0.0 113.688 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.2 t0 52.4 25.57 3.59 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.446 2.698 . . . . 0.0 113.668 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.75 137.78 26.21 Favored Glycine 0 C--N 1.34 0.759 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -70.76 124.01 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 126.528 1.931 . . . . 0.0 109.201 -176.562 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.44 97.36 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 40.3 tt0 -79.26 95.43 5.66 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.08 80.61 2.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -177.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -70.16 100.79 1.72 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 164.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.3 m -113.96 173.59 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 125.057 1.343 . . . . 0.0 108.977 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -124.35 104.44 8.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 162.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.41 ' OG ' ' OD2' ' A' ' 33' ' ' ASP . 5.6 t -154.43 155.5 35.08 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.013 0.824 . . . . 0.0 111.136 175.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.0 m -70.24 160.66 31.76 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.773 0.829 . . . . 0.0 111.626 -176.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.57 -42.36 67.49 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.307 1.043 . . . . 0.0 113.008 -173.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -70.53 -41.94 71.88 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.791 0.437 . . . . 0.0 111.12 -171.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.41 ' OD2' ' OG ' ' A' ' 29' ' ' SER . 16.2 t70 -64.43 -47.46 79.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.843 0.857 . . . . 0.0 109.609 171.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tt -54.71 -40.4 69.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.89 -0.506 . . . . 0.0 111.504 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -70.22 -40.8 74.31 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 121.133 -0.979 . . . . 0.0 111.471 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.9 m -65.73 -47.95 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.567 0.747 . . . . 0.0 110.327 177.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.03 -34.48 59.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -171.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.23 -47.92 80.41 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 118.127 -0.94 . . . . 0.0 108.933 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.09 -33.4 75.4 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.2 -1.4 . . . . 0.0 112.098 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.9 -42.93 89.6 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 118.497 -1.281 . . . . 0.0 110.03 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -69.42 -27.28 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.985 0.914 . . . . 0.0 112.295 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.29 -39.26 65.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.474 0.71 . . . . 0.0 110.983 171.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.7 t -71.73 -69.11 0.41 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.992 1.717 . . . . 0.0 111.943 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.85 -35.63 0.11 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -158.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.16 165.54 23.38 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -146.49 172.75 13.07 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 125.311 1.444 . . . . 0.0 107.722 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -79.53 -50.35 10.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.911 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t 66.19 125.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.589 2.356 . . . . 0.0 111.269 -172.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.9 p -71.49 152.72 93.92 Favored Pre-proline 0 CA--C 1.538 0.506 0 O-C-N 120.934 -1.104 . . . . 0.0 109.961 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.76 -25.48 60.91 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.228 1.952 . . . . 0.0 112.94 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.94 -56.39 22.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.289 0.495 . . . . 0.0 109.733 170.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.8 m -63.57 -35.59 80.99 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.471 0.578 . . . . 0.0 111.773 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.65 71.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.569 1.077 . . . . 0.0 111.545 174.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.6 m -80.56 -42.65 21.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.281 1.032 . . . . 0.0 111.389 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -85.55 -18.5 33.24 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.662 0.785 . . . . 0.0 112.573 -173.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 130.653 3.581 . . . . 0.0 110.779 -173.449 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -71.11 -57.13 4.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 118.038 0.919 . . . . 0.0 109.747 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -73.12 81.19 1.27 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 173.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.4 102.85 3.89 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.668 0.787 . . . . 0.0 109.617 -173.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.04 131.35 36.24 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 159.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -133.1 161.27 64.77 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 125.668 1.587 . . . . 0.0 106.768 170.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -64.62 168.23 13.62 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.229 1.952 . . . . 0.0 110.031 169.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.3 mm-40 54.66 -64.78 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 128.834 2.854 . . . . 0.0 113.235 -167.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.507 ' HG3' HH11 ' A' ' 9' ' ' ARG . 0.0 OUTLIER -61.04 86.0 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 129.075 2.95 . . . . 0.0 111.774 -172.263 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -122.21 152.45 39.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.178 1.391 . . . . 0.0 109.196 -171.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.74 101.79 6.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.5 mt -107.82 102.13 13.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -74.37 103.19 4.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.239 -0.913 . . . . 0.0 109.933 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.3 t -96.17 -177.45 3.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.226 1.41 . . . . 0.0 108.562 168.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.16 158.74 42.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.915 0.864 . . . . 0.0 110.486 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.1 t -74.56 98.95 3.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 164.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 29.3 t -57.37 -15.4 6.39 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -172.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -95.54 -15.36 22.91 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 117.55 -1.214 . . . . 0.0 114.051 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -129.4 1.05 5.08 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 120.588 1.54 . . . . 0.0 114.134 175.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t0 52.43 22.56 2.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 128.349 2.659 . . . . 0.0 113.423 -171.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.45 143.28 38.64 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.92 118.58 14.95 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.071 2.148 . . . . 0.0 110.21 -173.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.0 mt -124.69 90.82 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-O 122.143 0.973 . . . . 0.0 108.78 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.33 100.8 0.86 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.575 1.15 . . . . 0.0 109.71 170.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 mt -79.82 73.47 6.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -69.09 102.16 1.58 Allowed 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.5 m -124.08 170.92 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 125.611 1.564 . . . . 0.0 108.908 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -120.91 99.49 6.54 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 t -150.89 156.24 40.81 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-O 120.896 0.379 . . . . 0.0 110.872 178.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -67.63 162.06 24.4 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.749 0.82 . . . . 0.0 111.68 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.85 65.95 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.522 1.129 . . . . 0.0 112.546 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -72.73 -37.05 67.88 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.13 0.572 . . . . 0.0 111.638 -171.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.43 -44.69 74.41 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.575 0.75 . . . . 0.0 109.767 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.44 -45.61 66.07 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 118.271 0.487 . . . . 0.0 110.365 170.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.86 76.0 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.617 0.767 . . . . 0.0 109.984 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.7 m -60.59 -47.01 88.07 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 124.005 0.922 . . . . 0.0 110.383 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.47 -35.71 46.27 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -171.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.12 -34.91 79.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -67.35 -50.75 58.6 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.549 0.613 . . . . 0.0 111.174 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.05 -41.63 96.95 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.596 0.635 . . . . 0.0 111.63 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -83.76 -11.94 56.4 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.041 0.536 . . . . 0.0 111.975 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.6 mt -83.79 -34.59 24.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.362 0.983 . . . . 0.0 111.105 162.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -66.06 -66.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.872 1.269 . . . . 0.0 111.078 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -153.53 -40.66 0.1 Allowed 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 -158.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.36 157.78 37.02 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.4 p -146.6 168.7 20.63 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.01 -1.056 . . . . 0.0 109.732 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -103.76 31.43 4.45 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.386 0.674 . . . . 0.0 111.0 -172.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.7 p -26.26 106.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.869 2.468 . . . . 0.0 112.734 -171.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.47 148.85 63.49 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.864 -162.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -61.99 -26.57 78.73 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.278 1.985 . . . . 0.0 112.712 -173.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -60.64 -56.36 22.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.143 170.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 70.4 m -63.65 -36.8 85.02 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 119.046 0.839 . . . . 0.0 111.629 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.63 72.18 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.136 0.88 . . . . 0.0 111.679 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 m -80.25 -46.75 15.72 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.254 1.022 . . . . 0.0 111.258 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -82.7 -26.18 32.28 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.646 0.778 . . . . 0.0 112.2 -170.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.252 1.234 1 C-N-CA 133.324 4.65 . . . . 0.0 110.3 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.151 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 m -165.89 167.81 16.42 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.382 1.873 . . . . 0.0 106.725 170.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -138.55 -176.91 4.63 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.407 1.083 . . . . 0.0 108.574 175.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 42.3 ttp -150.52 173.09 14.49 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 106.006 -1.849 . . . . 0.0 106.006 163.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 57.53 69.65 0.72 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.73 1.612 . . . . 0.0 110.831 -174.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -134.25 163.78 48.72 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.144 1.778 . . . . 0.0 108.129 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -66.89 168.52 16.87 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 N-CA-C 107.694 -1.695 . . . . 0.0 107.694 158.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.26 1.1 mp0 63.26 -75.79 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.549 1.139 . . . . 0.0 112.473 -173.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -55.34 100.53 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.513 1.925 . . . . 0.0 112.332 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -128.42 137.62 51.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.826 1.25 . . . . 0.0 109.504 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 99.55 8.87 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.557 0.743 . . . . 0.0 109.697 174.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 71.0 mt -93.51 101.81 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.56 102.66 1.19 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.487 1.915 . . . . 0.0 109.338 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.8 t -110.23 -175.13 2.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.092 1.757 . . . . 0.0 109.75 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.86 153.89 37.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.619 1.168 . . . . 0.0 110.853 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.2 t -73.62 106.55 5.43 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.337 1.855 . . . . 0.0 108.116 169.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.0 t -57.48 -10.07 1.32 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.574 1.95 . . . . 0.0 114.372 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -114.49 -10.91 12.52 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.888 1.275 . . . . 0.0 114.346 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 p -132.61 -0.51 3.53 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.7 1.591 . . . . 0.0 114.487 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t0 52.38 23.96 2.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.0 2.52 . . . . 0.0 113.492 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.75 139.79 16.68 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.55 -1.82 . . . . 0.0 108.55 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.38 140.78 29.7 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 112.067 -162.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 mt -126.05 107.28 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -78.1 92.76 4.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.6 mt -71.5 82.74 0.81 Allowed 'General case' 0 C--N 1.344 0.327 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 m -75.68 95.34 3.39 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.04 168.22 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 124.857 1.263 . . . . 0.0 107.969 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -124.53 97.64 5.39 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 166.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 t -143.92 167.77 21.54 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.704 0.402 . . . . 0.0 111.175 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 53.7 m -87.57 168.77 12.76 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.782 -1.199 . . . . 0.0 110.458 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.36 -48.07 68.86 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.572 1.149 . . . . 0.0 112.906 -172.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.61 -50.26 65.71 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.728 -0.654 . . . . 0.0 109.976 -172.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -57.89 -43.72 86.25 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.28 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.57 -38.63 72.24 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.012 0.823 . . . . 0.0 111.58 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -44.65 64.66 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.691 1.196 . . . . 0.0 111.762 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 m -71.44 -41.73 69.09 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.974 1.309 . . . . 0.0 109.698 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.97 -38.1 64.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.36 -42.77 96.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.141 -1.023 . . . . 0.0 109.821 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -68.7 -35.88 77.74 Favored 'General case' 0 CA--C 1.504 -0.816 0 C-N-CA 118.003 -1.479 . . . . 0.0 111.916 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.8 mt -67.2 -40.55 86.48 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 118.667 -1.213 . . . . 0.0 110.52 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -72.19 -28.82 63.45 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.38 1.072 . . . . 0.0 111.308 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -71.78 -36.59 70.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.846 0.748 . . . . 0.0 111.292 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.8 t -71.3 -69.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.852 1.661 . . . . 0.0 111.936 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -150.98 -29.45 0.19 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 -158.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 166.72 16.47 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.568 0.699 . . . . 0.0 109.148 168.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.2 m -167.16 -178.37 4.1 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.439 1.896 . . . . 0.0 106.984 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.49 176.26 8.87 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.185 0.594 . . . . 0.0 110.127 -171.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.61 138.61 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 125.899 1.68 . . . . 0.0 107.693 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.9 p -80.06 154.11 74.94 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.882 0.473 . . . . 0.0 109.917 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.74 -26.96 60.24 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.54 2.16 . . . . 0.0 112.949 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.27 -61.94 2.06 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.121 0.969 . . . . 0.0 109.503 170.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 95.6 m -64.97 -34.97 79.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 118.822 -0.608 . . . . 0.0 112.277 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.31 -35.48 71.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.21 0.914 . . . . 0.0 111.43 172.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -80.61 -44.06 19.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.172 0.989 . . . . 0.0 111.248 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.52 -22.8 53.94 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.982 0.913 . . . . 0.0 112.506 -176.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 C-N-CA 130.257 3.423 . . . . 0.0 111.597 -173.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.163 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.1 p -133.4 -90.29 0.38 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -74.53 88.3 2.13 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 167.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -137.22 146.58 45.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.896 1.278 . . . . 0.0 108.504 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.84 18.03 0.79 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.34 1.856 . . . . 0.0 113.342 -172.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -85.16 155.69 60.42 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.71 0.804 . . . . 0.0 110.95 -170.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -71.46 75.96 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.784 2.989 . . . . 0.0 110.059 173.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.257 63.0 tt0 58.49 67.14 0.97 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.067 1.747 . . . . 0.0 110.027 171.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.24 100.91 0.85 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 126.014 1.725 . . . . 0.0 109.075 170.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -99.08 170.48 8.67 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.258 0.349 . . . . 0.0 110.543 173.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -116.54 123.56 47.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 168.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.9 mt -126.41 103.97 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 125.437 1.495 . . . . 0.0 107.572 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.76 109.44 2.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.924 0.89 . . . . 0.0 109.277 168.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.5 m -105.55 177.42 4.86 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.095 0.958 . . . . 0.0 109.5 167.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -135.92 155.79 36.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.521 0.677 . . . . 0.0 112.253 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.5 t -76.73 111.52 12.33 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.584 1.153 . . . . 0.0 109.098 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.0 t -61.86 -13.28 22.96 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -80.17 -50.5 10.2 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.622 1.556 . . . . 0.0 110.252 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.9 p -116.34 0.45 12.83 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.462 -161.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.8 t0 52.07 29.35 6.25 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.339 2.256 . . . . 0.0 111.653 -173.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -64.75 133.25 37.71 Favored Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -77.22 103.31 7.08 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 128.221 2.608 . . . . 0.0 109.402 -170.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.5 mt -118.61 88.93 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 122.312 1.053 . . . . 0.0 108.651 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.13 99.8 0.71 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.562 1.545 . . . . 0.0 108.896 170.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -83.5 161.93 21.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 171.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.9 t -136.12 126.0 25.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 157.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.6 m -143.77 141.96 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 -172.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -108.89 113.24 25.98 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -172.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.0 t -148.85 152.67 36.88 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.9 m -53.85 142.48 23.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.536 -1.666 . . . . 0.0 107.984 163.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.17 -35.55 17.14 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 125.493 1.517 . . . . 0.0 113.71 -171.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.38 -62.44 1.76 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.204 1.402 . . . . 0.0 110.396 -176.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -71.09 -23.56 62.14 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 122.158 -0.339 . . . . 0.0 111.022 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 tp -65.67 -40.85 92.85 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -49.64 76.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.029 0.932 . . . . 0.0 109.66 171.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.4 m -56.75 -51.38 69.12 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.979 0.809 . . . . 0.0 111.265 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.5 pp -74.74 -33.01 62.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.952 0.796 . . . . 0.0 109.742 -169.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.38 -36.66 77.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -65.76 -39.68 91.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.34 0.656 . . . . 0.0 110.971 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.4 mt -58.42 -49.73 76.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.565 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -67.02 -28.44 68.24 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.88 -35.52 67.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.794 0.725 . . . . 0.0 111.111 173.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -80.27 -71.79 0.44 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.175 1.39 . . . . 0.0 111.673 -173.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.0 m -147.38 -30.16 0.33 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.155 0.982 . . . . 0.0 113.188 -158.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.1 tp -72.21 152.75 42.02 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.9 p -142.09 173.64 11.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.969 0.907 . . . . 0.0 108.972 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -117.42 74.9 0.95 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -172.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -65.14 110.02 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.4 p -57.7 150.35 47.5 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 123.063 0.545 . . . . 0.0 110.968 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.26 -23.79 65.75 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.44 2.093 . . . . 0.0 112.615 -175.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -57.14 -55.42 34.99 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.861 0.864 . . . . 0.0 110.626 168.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 61.9 m -68.66 -29.93 68.51 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.78 0.832 . . . . 0.0 112.713 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.78 -43.85 97.71 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.163 0.892 . . . . 0.0 110.846 169.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.4 m -72.06 -45.53 60.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.562 1.145 . . . . 0.0 111.246 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -72.66 -23.52 60.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.023 0.529 . . . . 0.0 111.02 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 127.325 2.25 . . . . 0.0 110.723 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.341 0 N-CA-C 108.517 -1.833 . . . . 0.0 108.517 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 m -61.57 -8.63 4.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.579 1.151 . . . . 0.0 113.022 168.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -144.04 150.14 37.76 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 128.816 2.847 . . . . 0.0 107.077 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.3 tmm? -153.29 129.39 10.39 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 162.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -147.95 18.97 1.13 Allowed 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -84.61 149.54 54.57 Favored Pre-proline 0 C--N 1.323 -0.544 0 C-N-CA 123.102 0.561 . . . . 0.0 110.314 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.23 107.37 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.309 2.672 . . . . 0.0 109.731 -177.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 43.25 68.64 0.48 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.15 1.78 . . . . 0.0 112.936 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.4 105.61 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.404 0.681 . . . . 0.0 109.47 162.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -131.19 132.03 44.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.797 1.639 . . . . 0.0 110.053 -175.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -104.62 95.84 6.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.5 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 mt -97.13 98.14 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 -171.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' GLU . 1.2 tt -62.95 101.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.476 1.11 . . . . 0.0 110.445 177.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.4 m -104.23 -177.59 3.41 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.4 0.28 . . . . 0.0 111.349 176.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.45 155.39 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 O-C-N 120.953 -1.092 . . . . 0.0 111.147 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.3 t -70.94 120.42 16.48 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.879 1.272 . . . . 0.0 108.982 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.0 t -57.42 -25.8 60.15 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.202 1.401 . . . . 0.0 113.402 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -90.29 -48.31 7.22 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.001 0.818 . . . . 0.0 111.176 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.7 p -113.92 0.9 14.55 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.797 0.839 . . . . 0.0 112.815 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.8 t70 58.77 21.11 8.59 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.787 2.035 . . . . 0.0 112.546 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.36 140.4 30.75 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -176.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -65.0 109.07 2.0 Allowed 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 127.155 2.182 . . . . 0.0 109.007 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.7 mm -96.75 151.69 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 162.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 13' ' ' LEU . 1.6 tt0 -134.59 115.9 14.39 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 120.009 -1.682 . . . . 0.0 108.379 161.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -79.37 85.66 5.16 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.2 m -71.56 74.75 0.79 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.369 0.986 . . . . 0.0 108.971 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.5 m -101.49 178.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 122.406 1.098 . . . . 0.0 109.317 -177.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.33 113.11 14.56 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 128.394 2.677 . . . . 0.0 104.434 172.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.7 m -157.77 125.18 5.16 Favored 'General case' 0 N--CA 1.437 -1.087 0 O-C-N 120.184 -1.572 . . . . 0.0 109.979 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -65.12 151.63 45.59 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.034 1.334 . . . . 0.0 110.267 -175.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -44.06 -49.12 8.9 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.316 1.447 . . . . 0.0 114.865 -170.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.33 -36.46 58.25 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 121.29 0.567 . . . . 0.0 110.973 -167.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -47.91 75.61 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.417 1.087 . . . . 0.0 109.599 168.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.12 -39.43 94.01 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 122.0 -0.438 . . . . 0.0 111.297 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -64.0 1.04 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 167.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.2 m -51.92 -44.16 63.73 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.869 0.759 . . . . 0.0 111.005 -170.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.19 -36.22 64.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.431 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.91 -34.09 76.69 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.199 175.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -32.34 66.56 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.626 0.648 . . . . 0.0 110.697 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.39 -49.4 77.07 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.083 0.856 . . . . 0.0 110.559 170.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.46 -42.15 98.33 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.514 0.597 . . . . 0.0 110.845 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 tp -59.85 -39.59 85.7 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.509 1.123 . . . . 0.0 111.401 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.8 t -72.98 -63.65 1.13 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.562 1.145 . . . . 0.0 111.501 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -160.19 -27.09 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -158.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 tp -70.67 156.96 38.81 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.443 1.019 . . . . 0.0 109.026 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -161.92 172.63 15.71 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 125.845 1.658 . . . . 0.0 106.647 170.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -116.04 178.07 4.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.128 0.971 . . . . 0.0 109.214 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.6 131.73 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -69.47 152.12 96.49 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -62.99 -26.31 74.02 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.18 1.92 . . . . 0.0 112.65 -176.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -59.62 -59.27 5.7 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.055 0.542 . . . . 0.0 109.872 169.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.8 m -60.28 -35.17 74.93 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.865 0.757 . . . . 0.0 112.204 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.96 96.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.857 0.753 . . . . 0.0 110.672 175.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.2 m -75.24 -38.21 60.7 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.214 1.006 . . . . 0.0 111.555 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.86 -9.22 59.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.305 1.042 . . . . 0.0 111.915 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.414 10.4 pt20 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 128.953 2.901 . . . . 0.0 113.222 -171.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 108.747 -1.741 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 m -62.49 -18.88 62.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.919 0.86 . . . . 0.0 112.677 173.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -129.27 166.1 20.1 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.84 2.056 . . . . 0.0 107.176 163.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -88.43 152.89 21.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.529 0.68 . . . . 0.0 111.639 -174.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -139.06 137.06 35.91 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 160.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -140.28 162.49 49.49 Favored Pre-proline 0 C--O 1.233 0.228 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -170.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.75 146.36 97.45 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 N-CA-C 108.225 -1.49 . . . . 0.0 108.225 162.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 59.7 -58.81 0.06 Allowed 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 129.107 2.963 . . . . 0.0 114.672 -175.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 ttm-85 -63.12 92.95 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 N-CA-C 115.281 1.585 . . . . 0.0 115.281 -166.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.0 m170 -118.98 150.03 40.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.174 -1.376 . . . . 0.0 109.051 -173.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -123.57 83.91 2.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mt -90.24 97.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 tt -70.87 93.04 0.94 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 123.563 0.745 . . . . 0.0 110.016 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.4 t -81.1 171.75 14.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.145 0.978 . . . . 0.0 108.427 167.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.0 m -121.67 156.88 25.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.623 0.725 . . . . 0.0 109.571 164.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.0 t -76.88 108.22 9.77 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.218 1.407 . . . . 0.0 108.151 169.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.28 -4.66 0.88 Allowed 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -172.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -111.34 -16.87 13.27 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 120.354 1.434 . . . . 0.0 114.798 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 26.7 p -126.44 0.73 6.95 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.439 1.472 . . . . 0.0 113.952 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.1 t70 56.1 20.02 4.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.195 2.198 . . . . 0.0 112.864 -169.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.48 140.86 31.32 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 120.939 -1.101 . . . . 0.0 110.4 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 122.55 18.73 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.784 2.034 . . . . 0.0 109.724 -173.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.6 mt -124.06 99.01 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -82.7 92.6 7.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.064 0.546 . . . . 0.0 109.549 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -77.04 89.18 3.57 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -176.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.6 m -67.29 97.88 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.2 127.59 51.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 122.211 1.005 . . . . 0.0 110.204 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.88 92.35 7.77 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.7 p -132.68 142.99 49.34 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 127.313 2.245 . . . . 0.0 108.28 -158.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -83.53 -81.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 120.544 1.52 . . . . 0.0 112.393 -159.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -165.68 -61.42 0.03 OUTLIER 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.23 -40.89 70.8 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.038 1.335 . . . . 0.0 109.058 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -49.05 76.44 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.002 1.321 . . . . 0.0 109.953 171.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.57 -46.68 86.39 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.011 0.524 . . . . 0.0 110.185 178.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.72 -55.39 34.98 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.0 m -58.28 -47.84 82.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.494 -173.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -65.35 -35.15 80.09 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.329 0.513 . . . . 0.0 110.759 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.51 -43.42 98.89 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 175.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -61.71 -47.45 85.2 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.102 0.864 . . . . 0.0 109.413 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.73 -44.04 97.15 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.291 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -74.95 -24.49 58.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.489 0.716 . . . . 0.0 110.887 -175.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.46 -36.69 45.0 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.455 0.702 . . . . 0.0 111.047 169.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 t -69.01 -67.43 0.47 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.798 1.239 . . . . 0.0 111.662 -173.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.46 -41.36 0.09 Allowed 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -158.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 tp -69.68 150.01 47.44 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -143.78 167.23 22.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 124.003 0.921 . . . . 0.0 109.038 166.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -95.3 -30.35 14.0 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -162.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.4 t 61.21 113.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 127.853 2.461 . . . . 0.0 111.916 -175.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.0 p -66.36 153.56 92.44 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 120.949 -1.094 . . . . 0.0 110.343 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.13 -24.57 66.1 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 122.399 2.066 . . . . 0.0 112.704 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -58.76 -53.55 57.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.172 0.589 . . . . 0.0 110.402 170.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.1 m -66.82 -36.32 82.08 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.661 175.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.53 -28.98 67.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.1 1.318 . . . . 0.0 112.029 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.0 m -82.28 -43.97 16.86 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.53 1.132 . . . . 0.0 111.303 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.83 -40.47 22.45 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.553 0.741 . . . . 0.0 112.01 -172.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 . . . . . 0 C--O 1.256 1.397 1 C-N-CA 134.139 4.975 . . . . 0.0 112.07 172.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.052 0 N-CA-C 106.729 -2.548 . . . . 0.0 106.729 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -55.39 159.91 2.54 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 143.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -153.93 162.36 41.27 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.745 1.218 . . . . 0.0 108.643 178.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 56.2 ttm -157.31 140.41 15.33 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 162.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 128.91 90.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 131.307 3.843 . . . . 0.0 108.452 -169.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -138.89 161.19 59.57 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-O 119.107 -0.473 . . . . 0.0 109.89 -172.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.01 176.38 2.52 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.447 2.765 . . . . 0.0 110.704 171.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.297 0.9 OUTLIER 59.5 -84.8 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.978 1.711 . . . . 0.0 111.259 -169.614 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -51.29 103.45 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.936 1.244 . . . . 0.0 111.637 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -125.93 138.18 53.75 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -119.63 82.49 1.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.772 0.829 . . . . 0.0 108.91 -173.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.5 mt -90.35 101.25 12.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 -171.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 tt -74.82 87.07 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.326 1.05 . . . . 0.0 110.068 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.8 t -80.02 -171.5 2.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.178 1.391 . . . . 0.0 108.846 159.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 m -139.67 164.93 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 121.153 -0.967 . . . . 0.0 111.177 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.87 112.91 5.18 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 166.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -58.51 -18.96 33.31 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.917 0.887 . . . . 0.0 113.34 -171.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -109.01 -14.75 14.49 Favored 'General case' 0 C--N 1.345 0.389 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -128.33 2.28 5.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.644 1.565 . . . . 0.0 114.054 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 57.72 20.32 6.32 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.234 1.814 . . . . 0.0 112.989 -174.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.45 150.85 52.09 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 121.082 -1.011 . . . . 0.0 110.633 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.407 HH11 ' CG ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -66.51 112.01 3.88 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.705 2.002 . . . . 0.0 108.833 -172.61 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.0 mm -121.64 85.61 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 123.369 1.557 . . . . 0.0 108.05 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.82 121.24 15.04 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.443 159.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.1 mt -86.39 75.96 9.72 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 161.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.3 m -73.77 94.88 2.31 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 165.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.67 175.55 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.829 1.651 . . . . 0.0 108.45 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -120.47 119.87 34.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 162.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -143.25 169.01 18.43 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.639 1.176 . . . . 0.0 109.491 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 m -95.94 175.46 6.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 159.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.14 79.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.405 0.682 . . . . 0.0 111.958 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.09 -40.05 82.71 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.198 0.999 . . . . 0.0 110.764 -178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -63.51 -47.91 79.74 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.378 1.471 . . . . 0.0 109.404 173.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.83 -46.62 81.57 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.675 0.79 . . . . 0.0 109.962 175.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.0 ttt180 -59.88 -52.25 66.22 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.7 m -56.91 -52.23 65.98 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.241 1.016 . . . . 0.0 111.117 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.93 -31.49 72.69 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -63.16 -44.5 95.29 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 118.323 -0.846 . . . . 0.0 109.354 172.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.32 -46.1 89.51 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.523 1.056 . . . . 0.0 110.311 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -46.87 80.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.291 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -65.73 -26.59 67.81 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.795 0.685 . . . . 0.0 112.563 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -75.67 -33.87 60.43 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.317 1.847 . . . . 0.0 111.168 172.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -75.68 -67.37 0.67 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.112 0.965 . . . . 0.0 111.23 -172.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -157.76 -36.38 0.07 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.851 1.261 . . . . 0.0 112.515 -158.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.21 154.01 40.96 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.8 p -144.3 168.37 20.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.536 1.134 . . . . 0.0 108.189 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -91.5 -57.02 2.9 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 123.328 0.393 . . . . 0.0 110.665 -176.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t 67.85 134.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.714 2.406 . . . . 0.0 110.338 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.8 p -71.44 149.55 93.76 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.686 -1.259 . . . . 0.0 109.164 174.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.12 -25.48 65.67 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.316 2.01 . . . . 0.0 113.087 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -66.61 -37.92 85.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.936 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.3 m -76.29 -27.35 56.6 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 112.024 170.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.66 74.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.957 1.708 . . . . 0.0 110.718 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.2 m -76.63 -62.5 1.61 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.139 0.976 . . . . 0.0 111.219 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -83.9 -23.71 31.1 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -167.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 . . . . . 0 C--O 1.246 0.877 0 C-N-CA 128.402 2.681 . . . . 0.0 113.449 177.822 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.897 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 t 44.86 49.21 9.13 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.865 2.466 . . . . 0.0 112.304 -173.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 -132.49 -79.04 0.5 Allowed 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 168.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.436 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 30.8 ttm -148.15 178.88 8.18 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.564 2.746 . . . . 0.0 105.657 174.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.436 ' H ' ' HG2' ' A' ' 4' ' ' MET . . . 55.43 68.55 0.85 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.567 1.547 . . . . 0.0 110.761 -173.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -138.15 156.36 73.9 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 126.022 1.729 . . . . 0.0 107.722 -177.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.55 74.87 3.64 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.572 2.848 . . . . 0.0 110.643 -177.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 56.05 62.61 2.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.385 1.874 . . . . 0.0 111.301 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.59 108.04 0.21 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 126.539 1.936 . . . . 0.0 110.804 166.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -125.97 166.37 17.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 125.097 1.359 . . . . 0.0 110.303 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.46 89.27 3.01 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.7 mt -78.98 94.65 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.24 103.31 1.55 Allowed 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 121.221 -0.925 . . . . 0.0 109.255 170.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t -104.71 179.01 4.4 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.897 0.879 . . . . 0.0 108.865 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.1 m -134.25 153.94 36.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-O 121.747 0.784 . . . . 0.0 111.027 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 21' ' ' GLY . 42.6 t -73.88 115.13 12.96 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.359 1.464 . . . . 0.0 109.818 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 t -59.7 -13.34 9.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.551 1.54 . . . . 0.0 113.905 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -115.7 -11.24 11.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.7 p -136.09 1.86 2.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.943 1.701 . . . . 0.0 114.855 174.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 55.55 20.79 4.0 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 127.477 2.311 . . . . 0.0 113.5 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.428 ' H ' ' HB3' ' A' ' 16' ' ' CYS . . . -71.92 140.88 30.8 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 120.823 -1.173 . . . . 0.0 110.265 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -69.43 123.46 21.29 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.673 1.989 . . . . 0.0 109.391 -175.466 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.5 mp -119.61 106.49 19.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 164.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.474 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 41.2 tt0 -81.38 90.42 6.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.5 mt -70.2 86.42 0.57 Allowed 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.4 m -70.09 101.37 1.81 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.2 m -136.61 139.58 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.091 0.956 . . . . 0.0 108.617 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.5 mp0 -95.58 91.27 6.06 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.23 -2.137 . . . . 0.0 105.23 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.1 p -132.65 120.26 21.51 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 124.57 1.148 . . . . 0.0 109.872 -166.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -57.81 148.13 26.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.72 1.263 . . . . 0.0 109.452 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -50.9 -40.59 57.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.869 0.867 . . . . 0.0 113.042 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.9 -45.32 82.41 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.342 1.057 . . . . 0.0 111.764 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.75 -54.85 41.46 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tt -52.43 -48.63 65.64 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.039 0.936 . . . . 0.0 110.584 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -57.05 -48.09 79.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.679 0.791 . . . . 0.0 109.695 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -56.45 -50.12 72.62 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.604 0.762 . . . . 0.0 110.43 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.46 -43.7 71.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -67.5 -36.29 80.79 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.318 -169.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -62.04 -46.51 88.82 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 123.748 0.819 . . . . 0.0 109.634 173.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.03 -52.43 63.99 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 118.416 -0.802 . . . . 0.0 110.59 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -64.17 -29.23 70.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -70.67 -41.43 72.06 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.087 0.955 . . . . 0.0 111.251 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -70.15 -68.04 0.45 Allowed 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.727 1.611 . . . . 0.0 111.422 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -155.08 -34.19 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -158.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.1 tp -71.0 165.92 22.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.86 0.838 . . . . 0.0 109.154 175.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.5 m -159.38 -175.04 4.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -118.62 169.37 9.87 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.16 0.984 . . . . 0.0 108.712 -176.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.9 p -144.97 132.33 16.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.4 p -70.41 154.45 94.45 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.911 -0.566 . . . . 0.0 109.933 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -63.7 -31.59 69.19 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.243 1.962 . . . . 0.0 112.719 -174.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -56.55 -49.92 73.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.745 0.818 . . . . 0.0 110.397 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 m -68.86 -31.19 69.97 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.167 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.14 71.04 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.093 1.315 . . . . 0.0 111.513 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.99 -16.62 18.65 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -108.84 -31.25 7.76 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.562 1.073 . . . . 0.0 111.964 176.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.27 69.1 mt-30 . . . . . 0 C--O 1.255 1.361 0 C-N-CA 129.787 3.235 . . . . 0.0 115.883 176.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.441 -0.896 0 CA-C-O 117.557 -1.211 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -54.05 89.17 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -128.97 133.23 47.72 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.662 1.185 . . . . 0.0 108.748 -168.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.48 94.89 5.57 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.261 1.024 . . . . 0.0 109.327 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.3 mt -96.41 98.66 7.91 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.727 HD13 ' HD2' ' A' ' 22' ' ' ARG 0.391 0.2 OUTLIER -84.1 124.33 31.0 Favored 'General case' 0 N--CA 1.439 -0.99 0 O-C-N 120.816 -1.177 . . . . 0.0 111.688 -177.987 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.1 t -120.5 -154.94 0.6 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.284 2.234 . . . . 0.0 108.055 172.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.439 ' CG1' HH21 ' A' ' 22' ' ' ARG . 13.4 m -137.17 159.97 36.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 O-C-N 120.502 -1.374 . . . . 0.0 111.22 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.2 t -66.02 110.97 3.13 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -56.91 -11.51 1.5 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.617 1.967 . . . . 0.0 114.232 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -121.21 -14.66 8.31 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -175.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -125.66 2.79 7.53 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.08 1.309 . . . . 0.0 113.778 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.3 t70 58.13 15.91 3.55 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.861 2.464 . . . . 0.0 113.678 -177.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.06 146.83 28.35 Favored Glycine 0 C--N 1.342 0.871 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -174.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.727 ' HD2' HD13 ' A' ' 13' ' ' LEU . 1.8 tpp85 -70.92 119.14 14.61 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 124.548 1.139 . . . . 0.0 110.573 -166.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 78.6 mt -109.26 100.11 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 169.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.29 97.18 1.53 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 163.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.69 82.92 0.87 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.0 m -69.97 102.17 1.95 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -118.55 172.94 5.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 C-N-CA 124.676 1.19 . . . . 0.0 108.619 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -120.98 92.91 3.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 165.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -133.31 131.08 39.74 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.789 0.835 . . . . 0.0 109.118 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 m -62.53 162.21 10.73 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.4 62.41 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 122.904 0.482 . . . . 0.0 112.254 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -75.19 -33.98 61.49 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -67.09 -45.66 76.6 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.37 0.668 . . . . 0.0 109.421 171.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.97 -44.0 86.81 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.567 0.747 . . . . 0.0 110.158 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.79 -53.43 54.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.807 1.243 . . . . 0.0 109.392 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.6 m -59.05 -51.13 71.38 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.788 0.835 . . . . 0.0 109.984 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.16 -28.46 68.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.582 -0.723 . . . . 0.0 110.583 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -50.87 69.38 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 118.826 0.739 . . . . 0.0 109.326 170.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -62.54 -41.05 98.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -175.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.91 -49.13 77.42 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.172 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.36 -34.07 77.13 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.352 0.524 . . . . 0.0 111.635 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.0 tt -66.61 -38.67 87.45 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.191 0.996 . . . . 0.0 110.816 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.8 t -70.88 -67.57 0.5 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.331 1.452 . . . . 0.0 111.452 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -153.89 -36.63 0.1 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -158.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 tp -66.12 148.0 52.48 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.524 0.678 . . . . 0.0 109.604 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.8 m -160.5 168.14 25.72 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -121.02 174.02 6.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.853 1.661 . . . . 0.0 107.881 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.0 m -133.22 148.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 C-N-CA 126.588 1.955 . . . . 0.0 108.164 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.6 p -75.28 157.04 85.32 Favored Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -64.2 -27.0 64.45 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.188 1.925 . . . . 0.0 113.128 -174.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 43.0 t90 -58.5 -59.88 4.68 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.008 0.523 . . . . 0.0 109.767 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.2 m -58.77 -42.86 89.96 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.799 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.44 68.43 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.137 0.881 . . . . 0.0 112.409 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.1 m -79.68 -35.98 38.36 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.806 0.843 . . . . 0.0 111.241 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.77 -49.19 10.7 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 118.591 -0.719 . . . . 0.0 111.418 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 . . . . . 0 C--O 1.25 1.109 1 C-N-CA 133.966 4.907 . . . . 0.0 108.961 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.67 101.31 0.07 Allowed 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.229 1.412 . . . . 0.0 111.532 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -126.38 152.18 46.65 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.333 1.453 . . . . 0.0 109.125 -173.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -125.51 96.35 4.77 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.0 mt -97.31 97.76 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -171.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.88 102.34 0.77 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 p -98.9 -172.27 2.26 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 162.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -130.7 151.69 36.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 121.779 0.8 . . . . 0.0 110.565 174.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -70.27 106.38 3.32 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.283 1.833 . . . . 0.0 108.335 162.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -59.9 -8.73 2.38 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 114.141 -174.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -114.1 -14.74 12.34 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.9 p -122.09 -0.82 9.38 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.005 1.275 . . . . 0.0 113.307 170.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.8 t0 50.97 23.33 1.44 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.514 2.325 . . . . 0.0 112.782 -169.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.63 137.46 18.16 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -76.42 139.12 40.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.231 -0.984 . . . . 0.0 109.807 -170.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.0 mt -130.42 98.62 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -72.8 87.89 1.3 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.502 1.521 . . . . 0.0 109.552 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.0 mt -70.22 86.68 0.58 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.845 0.858 . . . . 0.0 108.79 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.3 m -72.2 105.25 3.93 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 169.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.6 m -124.28 173.49 10.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 125.365 1.466 . . . . 0.0 109.204 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -125.11 99.76 6.25 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -157.95 130.26 7.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.693 -1.255 . . . . 0.0 108.634 -164.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 m -65.67 165.77 11.93 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -158.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.0 46.89 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.193 1.397 . . . . 0.0 113.635 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.14 -50.84 62.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -54.56 -44.79 73.23 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.874 0.87 . . . . 0.0 110.543 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.48 -48.68 76.61 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.259 0.624 . . . . 0.0 110.662 174.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.15 -53.93 48.35 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 m -58.97 -49.87 76.24 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 124.162 0.985 . . . . 0.0 110.467 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.91 -32.72 74.56 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.32 0.964 . . . . 0.0 111.493 176.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -57.86 -45.84 85.7 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 173.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -60.19 -42.05 94.21 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 118.909 0.777 . . . . 0.0 110.364 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.9 mt -59.48 -49.96 75.75 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.109 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -65.97 -33.36 75.64 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.174 0.443 . . . . 0.0 111.61 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.26 -38.59 90.79 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.829 0.74 . . . . 0.0 111.391 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 t -74.31 -58.94 2.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.63 1.172 . . . . 0.0 111.168 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.1 m -163.37 -23.24 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.45 142.97 58.24 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 120.074 1.307 . . . . 0.0 110.056 -173.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.3 m -155.79 166.72 32.64 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 165.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -119.77 -172.88 2.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -165.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.52 126.86 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.4 p -68.73 150.32 97.67 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.93 -28.66 66.87 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.143 1.895 . . . . 0.0 113.523 -169.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -61.44 -49.82 75.29 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.808 0.443 . . . . 0.0 110.792 171.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.6 m -68.15 -32.78 73.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.842 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.01 -32.08 73.63 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 120.012 1.278 . . . . 0.0 111.437 173.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.8 m -76.48 -49.74 15.81 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.428 1.091 . . . . 0.0 110.928 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -85.69 -16.72 38.14 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.767 0.827 . . . . 0.0 112.544 -173.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 131.038 3.735 . . . . 0.0 114.956 -177.985 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.622 0 CA-C-O 118.058 -0.973 . . . . 0.0 111.22 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -53.3 92.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.478 2.311 . . . . 0.0 112.586 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -126.47 160.92 29.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.138 0.975 . . . . 0.0 110.167 -175.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -133.45 98.09 4.13 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.275 -0.89 . . . . 0.0 110.254 -168.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.2 mm -86.95 100.22 9.51 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.519 HD21 ' HD3' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -66.83 86.75 0.13 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.108 0.963 . . . . 0.0 109.68 173.756 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.4 t -89.26 176.73 6.83 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.332 1.453 . . . . 0.0 110.018 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -123.75 158.48 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.322 1.049 . . . . 0.0 110.318 163.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -73.99 115.16 13.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.637 1.975 . . . . 0.0 109.351 169.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.5 t -55.95 -24.44 38.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.066 1.746 . . . . 0.0 113.977 -173.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.44 -41.87 9.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.88 1.218 . . . . 0.0 112.723 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -110.93 -3.64 15.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.7 t0 49.8 38.53 15.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.691 1.996 . . . . 0.0 112.054 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.2 144.86 17.37 Favored Glycine 0 C--N 1.341 0.829 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 170.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.519 ' HD3' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -81.5 149.62 28.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.909 -165.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.94 108.46 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -80.31 91.9 5.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.791 0.836 . . . . 0.0 108.762 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -74.81 87.16 2.24 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -176.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -71.45 95.68 1.4 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 171.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -104.62 172.57 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.383 1.473 . . . . 0.0 109.503 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -123.57 107.47 11.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.217 -1.771 . . . . 0.0 106.217 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.3 t -151.17 169.19 22.48 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.998 0.519 . . . . 0.0 109.808 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.6 m -82.34 170.28 15.52 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.555 -1.341 . . . . 0.0 110.643 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.03 74.42 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.186 0.594 . . . . 0.0 111.285 -174.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 32' ' ' GLU . 1.7 mp0 -62.3 -52.73 62.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.76 2.024 . . . . 0.0 109.918 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.88 -46.74 77.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.486 1.114 . . . . 0.0 109.818 177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.96 -47.19 68.32 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.119 0.418 . . . . 0.0 111.065 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -64.72 -49.65 70.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.4 m -58.69 -50.12 75.04 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.445 0.298 . . . . 0.0 110.365 -176.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.89 -31.94 72.87 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.875 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.23 -41.97 89.92 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 119.611 1.096 . . . . 0.0 108.724 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -63.67 -43.6 96.22 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-N 119.264 0.938 . . . . 0.0 110.313 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.42 -42.7 99.15 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.261 0.482 . . . . 0.0 112.002 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -73.89 -30.82 62.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.788 0.435 . . . . 0.0 111.231 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.3 mt -69.44 -35.61 75.85 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.923 0.783 . . . . 0.0 111.131 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.3 t -67.58 -68.9 0.35 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.461 1.505 . . . . 0.0 110.935 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -36.65 0.1 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -158.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.14 153.0 43.67 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.481 0.658 . . . . 0.0 109.76 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.5 m -165.79 167.87 16.54 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 126.017 1.727 . . . . 0.0 107.126 170.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -115.97 -179.72 3.74 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.214 1.405 . . . . 0.0 108.854 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -134.48 132.66 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 126.766 2.027 . . . . 0.0 105.856 -178.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.1 p -70.14 151.52 95.96 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -62.03 -30.95 83.64 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.929 1.752 . . . . 0.0 112.125 -175.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -56.89 -48.68 77.63 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.287 0.494 . . . . 0.0 111.066 171.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.1 m -69.69 -28.32 65.74 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.278 -0.867 . . . . 0.0 112.413 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.65 81.59 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.378 0.99 . . . . 0.0 110.213 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.8 m -65.55 -47.94 74.13 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.868 0.867 . . . . 0.0 112.006 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.62 -24.0 59.97 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.276 0.489 . . . . 0.0 111.669 -176.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 127.596 2.358 . . . . 0.0 112.621 170.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -64.59 101.68 0.48 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.656 1.582 . . . . 0.0 112.73 -172.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -135.48 109.98 8.52 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.152 -1.386 . . . . 0.0 109.989 -159.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -87.11 110.89 20.42 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.91 1.284 . . . . 0.0 108.837 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.0 mt -112.08 98.47 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.87 110.72 2.97 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.218 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.9 t -109.65 -179.21 3.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.407 0.683 . . . . 0.0 109.98 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.3 m -136.95 153.29 29.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 122.051 0.929 . . . . 0.0 112.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 48' ' ' VAL . 45.4 t -65.38 119.37 10.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.675 163.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.4 t -56.52 -18.67 12.36 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.29 1.436 . . . . 0.0 114.657 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HE3' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -125.28 -16.92 5.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -164.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.9 p -121.71 0.63 9.87 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.816 0.846 . . . . 0.0 113.072 169.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.59 19.85 4.52 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.302 1.841 . . . . 0.0 112.647 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.0 131.46 36.41 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -71.88 114.67 10.22 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 127.286 2.234 . . . . 0.0 109.621 -169.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.1 mm -110.15 134.57 51.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -105.91 93.28 4.55 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 174.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -79.68 82.49 5.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . 0.339 5.7 t -73.62 103.52 4.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 117.514 -1.674 . . . . 0.0 108.674 161.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.73 172.02 1.19 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 158.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.61 93.71 3.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 160.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.2 t -158.05 171.73 19.71 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.67 0.388 . . . . 0.0 111.256 -167.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.1 t -68.47 166.7 16.32 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.852 0.834 . . . . 0.0 111.678 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.72 72.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.951 1.3 . . . . 0.0 111.369 167.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -68.14 -48.79 64.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.025 0.93 . . . . 0.0 110.057 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -67.94 -46.27 71.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.802 1.241 . . . . 0.0 109.865 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tt -48.91 -51.61 29.09 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 118.348 0.522 . . . . 0.0 110.271 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -59.93 -55.86 28.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 m -53.17 -53.04 56.34 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.193 0.997 . . . . 0.0 110.063 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -34.85 79.21 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.058 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.47 -46.86 88.53 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 117.185 -1.388 . . . . 0.0 109.476 170.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -46.36 82.35 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 121.128 1.785 . . . . 0.0 109.862 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -70.45 -43.63 69.47 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -67.44 -23.36 65.51 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.35 -34.18 48.58 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.262 1.825 . . . . 0.0 110.844 171.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.3 t -66.75 -67.54 0.44 Allowed 'General case' 0 C--N 1.339 0.152 0 C-N-CA 124.302 1.041 . . . . 0.0 110.287 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -44.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.775 0.83 . . . . 0.0 112.384 -158.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.01 139.09 55.25 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -144.96 161.98 38.03 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -172.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -118.31 68.75 0.78 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 117.963 0.347 . . . . 0.0 110.919 -158.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.408 ' HA ' ' SG ' ' A' ' 16' ' ' CYS . 35.7 m -62.33 113.19 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-O 121.64 0.733 . . . . 0.0 109.671 -177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.1 p -57.97 152.96 36.24 Favored Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 124.21 1.004 . . . . 0.0 110.317 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -63.72 -25.87 68.53 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.303 2.002 . . . . 0.0 113.096 -171.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.3 t90 -60.79 -53.32 58.81 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.292 0.497 . . . . 0.0 109.848 169.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.409 ' SG ' ' HE3' ' A' ' 18' ' ' LYS . 10.0 m -62.62 -36.74 83.76 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.919 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.5 88.61 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.597 0.635 . . . . 0.0 111.296 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 m -74.06 -42.06 60.8 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.306 1.042 . . . . 0.0 111.402 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -86.67 -19.86 28.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.436 0.694 . . . . 0.0 112.336 -172.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.549 2.34 . . . . 0.0 111.156 -173.095 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -55.0 93.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 127.522 2.329 . . . . 0.0 111.478 172.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.6 m170 -125.29 143.97 50.7 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.888 1.275 . . . . 0.0 110.451 -168.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.57 82.19 1.68 Allowed 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.118 0.567 . . . . 0.0 109.711 -176.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.82 100.91 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -72.56 100.06 2.67 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 120.928 -1.107 . . . . 0.0 109.778 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.45 -173.94 4.77 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 160.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.45 159.41 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.641 1.176 . . . . 0.0 110.01 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.27 113.28 9.14 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.769 2.028 . . . . 0.0 108.558 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.4 t -56.9 -18.65 14.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.17 1.788 . . . . 0.0 113.458 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.32 -16.19 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.0 p -129.9 -0.8 4.75 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.749 1.613 . . . . 0.0 114.475 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 55.1 24.06 5.8 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.556 1.943 . . . . 0.0 113.217 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.56 146.37 28.61 Favored Glycine 0 C--N 1.34 0.78 0 N-CA-C 108.714 -1.754 . . . . 0.0 108.714 175.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.79 141.12 39.42 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.613 -166.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mm -121.93 94.09 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -74.25 95.46 2.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.321 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.94 74.06 5.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.3 m -75.39 96.65 3.46 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 167.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.92 157.48 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 C-N-CA 126.143 1.777 . . . . 0.0 108.589 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -104.82 102.59 12.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 -178.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -151.97 156.73 40.61 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 118.057 0.39 . . . . 0.0 110.283 173.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 163.33 21.72 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.234 0.614 . . . . 0.0 111.928 -174.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.61 -34.89 74.91 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.643 0.777 . . . . 0.0 111.329 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.65 -48.92 78.65 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.323 1.849 . . . . 0.0 110.547 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -69.18 -46.99 66.13 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.949 0.9 . . . . 0.0 109.857 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -50.12 -46.14 53.51 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.285 0.634 . . . . 0.0 110.881 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -66.22 -51.79 54.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.8 0.84 . . . . 0.0 109.416 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.6 m -58.05 -51.99 67.39 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.997 0.919 . . . . 0.0 110.078 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.67 -31.44 72.66 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.138 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.39 -51.68 61.78 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.296 0.953 . . . . 0.0 108.871 170.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -59.65 -43.77 93.79 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.31 -47.2 86.28 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.164 0.438 . . . . 0.0 112.053 177.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -71.86 -25.74 62.07 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.034 0.534 . . . . 0.0 112.315 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.97 -43.26 75.33 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.389 0.995 . . . . 0.0 110.561 166.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.7 t -66.85 -54.89 17.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.747 1.219 . . . . 0.0 111.22 -172.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 83.2 m -160.25 -27.18 0.06 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 156.78 38.14 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 120.027 1.285 . . . . 0.0 110.685 -171.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.1 m -164.96 171.24 14.26 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.744 1.617 . . . . 0.0 108.35 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -128.38 -179.95 5.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.738 1.215 . . . . 0.0 109.425 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.3 p -147.07 136.83 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.613 1.565 . . . . 0.0 107.146 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.6 p -72.78 154.58 91.17 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.147 -0.454 . . . . 0.0 109.947 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.9 -27.54 58.78 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.34 2.027 . . . . 0.0 112.819 -177.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -58.25 -57.62 12.07 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.063 0.545 . . . . 0.0 109.54 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 m -59.76 -39.5 85.04 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.633 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.537 1.062 . . . . 0.0 111.4 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -76.82 -31.83 57.19 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.455 1.102 . . . . 0.0 111.782 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.98 -6.71 41.75 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.272 1.029 . . . . 0.0 112.705 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.322 14.8 pt20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 129.581 3.152 . . . . 0.0 113.856 -171.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 123.889 1.805 . . . . 0.0 113.483 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -66.12 88.48 0.12 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 110.743 -2.935 . . . . 0.0 108.246 167.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.8 m170 -105.26 173.61 6.23 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.564 1.946 . . . . 0.0 110.683 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.22 93.72 3.64 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 125.345 1.458 . . . . 0.0 107.77 175.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 mt -95.09 100.31 10.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -173.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.8 tt -66.69 112.06 4.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.763 0.825 . . . . 0.0 109.453 175.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 p -108.54 -169.91 1.58 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.125 0.57 . . . . 0.0 110.35 160.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -125.08 165.75 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 122.94 0.496 . . . . 0.0 109.85 165.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.5 t -68.16 124.19 22.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.123 1.369 . . . . 0.0 107.653 160.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.87 -7.05 6.98 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -172.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -137.72 -8.68 1.64 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.6 p -128.75 1.58 5.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.883 1.273 . . . . 0.0 110.469 167.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.73 29.55 9.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.301 2.64 . . . . 0.0 112.49 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.49 141.95 25.32 Favored Glycine 0 C--N 1.339 0.701 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -71.51 120.7 17.46 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 126.766 2.026 . . . . 0.0 110.586 -170.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.53 106.98 18.58 Favored 'Isoleucine or valine' 0 C--N 1.346 0.428 0 CA-C-N 119.928 1.24 . . . . 0.0 108.175 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -79.86 92.46 5.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.832 0.853 . . . . 0.0 109.362 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.4 mt -69.45 90.18 0.52 Allowed 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.1 m -74.88 100.37 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.72 154.2 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 124.421 1.089 . . . . 0.0 109.325 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -113.8 110.11 19.62 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.2 m -155.15 112.6 3.35 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -160.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.4 m -71.13 156.48 39.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.978 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.96 -38.48 62.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -166.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.95 -56.2 9.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.722 1.209 . . . . 0.0 110.664 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -56.97 -38.04 72.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.355 1.862 . . . . 0.0 111.402 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.22 -42.95 96.37 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.381 1.472 . . . . 0.0 109.174 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.92 -42.51 98.25 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.314 0.646 . . . . 0.0 110.367 173.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.6 m -60.96 -54.47 44.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.757 0.708 . . . . 0.0 110.196 175.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.42 -29.64 68.35 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.989 0.813 . . . . 0.0 111.891 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -55.74 -51.4 67.49 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 125.72 1.608 . . . . 0.0 108.183 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -70.63 -33.38 70.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.013 0.525 . . . . 0.0 111.102 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.13 -50.48 71.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.53 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -62.94 -34.63 77.88 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.801 0.728 . . . . 0.0 111.446 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 tt -68.62 -37.78 80.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 0.0 110.711 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 t -70.83 -69.34 0.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.575 1.55 . . . . 0.0 111.796 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -154.9 -32.08 0.1 Allowed 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -158.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.7 tp -64.09 129.12 38.73 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.355 0.662 . . . . 0.0 109.531 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -133.87 166.5 22.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 168.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -122.89 167.45 13.54 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.271 1.428 . . . . 0.0 107.961 -174.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.2 t -140.13 132.67 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -174.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.8 p -69.31 153.43 95.9 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.6 -28.93 69.87 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.096 1.864 . . . . 0.0 113.086 -172.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -59.72 -60.31 4.04 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.521 0.601 . . . . 0.0 109.71 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.5 m -54.96 -43.8 73.8 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.902 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.57 74.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.812 0.733 . . . . 0.0 111.997 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.37 -25.15 39.32 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.345 1.058 . . . . 0.0 112.007 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -104.75 -12.27 16.41 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.614 0.765 . . . . 0.0 112.841 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 116.925 -1.512 . . . . 0.0 112.869 169.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 . . . . . 0 N--CA 1.441 -0.912 0 CA-C-O 117.1 -1.429 . . . . 0.0 112.89 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 110.16 0.7 Allowed 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 121.227 1.83 . . . . 0.0 110.739 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.44 164.8 28.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.524 -1.216 . . . . 0.0 108.721 -176.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.16 117.11 17.07 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -114.79 100.75 11.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.9 tp -72.05 86.24 1.03 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.609 1.964 . . . . 0.0 110.152 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -90.12 -171.66 3.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.458 0.703 . . . . 0.0 109.422 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.93 154.2 39.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 123.181 0.592 . . . . 0.0 110.526 170.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.86 106.47 2.3 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.717 1.207 . . . . 0.0 107.792 162.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.19 -3.18 0.79 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -172.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.65 -16.94 11.23 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 30.5 p -120.05 2.41 10.95 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.117 1.326 . . . . 0.0 112.688 170.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.2 t0 54.21 21.35 3.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.436 2.294 . . . . 0.0 112.578 -171.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.42 129.15 16.73 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -55.32 113.1 1.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 129.254 3.022 . . . . 0.0 108.681 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.251 0.6 OUTLIER -126.55 106.49 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 122.679 1.228 . . . . 0.0 109.327 -172.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -87.5 94.26 9.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.254 1.021 . . . . 0.0 109.097 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.65 87.04 1.65 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.9 m -71.79 101.79 2.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 170.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.9 m -107.33 170.41 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.046 1.338 . . . . 0.0 108.463 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -134.25 83.7 2.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 168.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.7 t -154.96 156.7 36.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.712 0.805 . . . . 0.0 109.498 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -72.38 166.28 22.85 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.717 0.807 . . . . 0.0 112.037 -172.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.07 -39.92 63.66 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.077 1.351 . . . . 0.0 113.708 -172.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.43 -42.08 88.22 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.93 0.892 . . . . 0.0 111.369 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -74.07 -41.45 61.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.749 0.82 . . . . 0.0 110.124 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.18 -50.48 49.16 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.287 0.635 . . . . 0.0 110.46 167.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.0 ttt-85 -64.63 -41.95 95.82 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 124.418 1.087 . . . . 0.0 110.628 -177.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 m -63.08 -53.81 47.76 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.817 0.447 . . . . 0.0 110.66 176.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.63 -30.85 69.66 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.144 0.577 . . . . 0.0 110.844 -174.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.13 -59.79 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.262 1.425 . . . . 0.0 108.098 164.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -59.94 -35.72 75.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 117.083 -1.437 . . . . 0.0 111.705 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -46.99 68.63 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.278 1.399 . . . . 0.0 113.903 167.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -67.1 -1.53 4.38 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -114.88 -27.91 7.24 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 126.356 1.862 . . . . 0.0 108.478 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.3 p -77.05 -52.31 9.54 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.257 0.551 . . . . 0.0 111.175 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -157.11 -39.93 0.07 Allowed 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.845 1.258 . . . . 0.0 113.007 -158.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.62 163.17 23.84 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.266 0.555 . . . . 0.0 110.198 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -144.69 170.45 16.07 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 168.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -91.1 -30.18 16.88 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.064 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.4 t 57.48 104.72 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 127.263 2.225 . . . . 0.0 111.942 -175.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.03 150.0 31.91 Favored Pre-proline 0 CA--C 1.537 0.472 0 O-C-N 121.352 -0.842 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.43 -25.72 63.27 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.27 1.98 . . . . 0.0 113.053 -172.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.99 -49.79 76.28 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 169.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 41.7 m -67.6 -34.06 76.25 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.828 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.48 67.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.998 1.272 . . . . 0.0 111.814 174.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -86.08 -52.56 5.61 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.881 1.272 . . . . 0.0 111.043 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -83.6 -18.4 38.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.373 1.069 . . . . 0.0 112.526 -171.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 . . . . . 0 C--O 1.248 0.991 0 C-N-CA 129.752 3.221 . . . . 0.0 113.606 171.646 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -52.74 100.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.657 1.583 . . . . 0.0 111.177 173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -130.13 153.43 48.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.878 1.271 . . . . 0.0 109.546 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -121.88 118.05 27.99 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.978 0.911 . . . . 0.0 108.653 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.5 mt -117.73 101.12 11.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.38 105.38 3.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.314 -0.867 . . . . 0.0 109.323 172.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.0 t -102.52 -179.76 4.07 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.406 1.082 . . . . 0.0 108.387 169.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -131.5 156.46 42.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.828 0.823 . . . . 0.0 109.292 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.31 99.71 2.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 162.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -58.78 -2.05 0.2 Allowed 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.194 1.554 . . . . 0.0 115.194 -173.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -114.69 -14.3 12.03 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.049 1.34 . . . . 0.0 114.449 177.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.4 p -126.08 1.32 7.22 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.565 1.529 . . . . 0.0 113.688 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.2 t0 52.4 25.57 3.59 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.446 2.698 . . . . 0.0 113.668 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.75 137.78 26.21 Favored Glycine 0 C--N 1.34 0.759 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -70.76 124.01 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 126.528 1.931 . . . . 0.0 109.201 -176.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.44 97.36 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 40.3 tt0 -79.26 95.43 5.66 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.08 80.61 2.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -177.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -70.16 100.79 1.72 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 164.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.3 m -113.96 173.59 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 125.057 1.343 . . . . 0.0 108.977 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -124.35 104.44 8.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 162.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.41 ' OG ' ' OD2' ' A' ' 33' ' ' ASP . 5.6 t -154.43 155.5 35.08 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.013 0.824 . . . . 0.0 111.136 175.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.0 m -70.24 160.66 31.76 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.773 0.829 . . . . 0.0 111.626 -176.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.57 -42.36 67.49 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.307 1.043 . . . . 0.0 113.008 -173.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -70.53 -41.94 71.88 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.791 0.437 . . . . 0.0 111.12 -171.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.41 ' OD2' ' OG ' ' A' ' 29' ' ' SER . 16.2 t70 -64.43 -47.46 79.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.843 0.857 . . . . 0.0 109.609 171.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tt -54.71 -40.4 69.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.89 -0.506 . . . . 0.0 111.504 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -70.22 -40.8 74.31 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 121.133 -0.979 . . . . 0.0 111.471 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.9 m -65.73 -47.95 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.567 0.747 . . . . 0.0 110.327 177.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.03 -34.48 59.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -171.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.23 -47.92 80.41 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 118.127 -0.94 . . . . 0.0 108.933 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.09 -33.4 75.4 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.2 -1.4 . . . . 0.0 112.098 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.9 -42.93 89.6 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 118.497 -1.281 . . . . 0.0 110.03 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -69.42 -27.28 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.985 0.914 . . . . 0.0 112.295 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.29 -39.26 65.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.474 0.71 . . . . 0.0 110.983 171.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.7 t -71.73 -69.11 0.41 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.992 1.717 . . . . 0.0 111.943 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.85 -35.63 0.11 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -158.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.16 165.54 23.38 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -146.49 172.75 13.07 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 125.311 1.444 . . . . 0.0 107.722 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -79.53 -50.35 10.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.911 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t 66.19 125.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.589 2.356 . . . . 0.0 111.269 -172.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.9 p -71.49 152.72 93.92 Favored Pre-proline 0 CA--C 1.538 0.506 0 O-C-N 120.934 -1.104 . . . . 0.0 109.961 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.76 -25.48 60.91 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.228 1.952 . . . . 0.0 112.94 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.94 -56.39 22.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.289 0.495 . . . . 0.0 109.733 170.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.8 m -63.57 -35.59 80.99 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.471 0.578 . . . . 0.0 111.773 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.65 71.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.569 1.077 . . . . 0.0 111.545 174.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.6 m -80.56 -42.65 21.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.281 1.032 . . . . 0.0 111.389 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -85.55 -18.5 33.24 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.662 0.785 . . . . 0.0 112.573 -173.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 130.653 3.581 . . . . 0.0 110.779 -173.449 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.3 mm-40 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.507 HH11 ' HG3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -61.04 86.0 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 129.075 2.95 . . . . 0.0 111.774 -172.263 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -122.21 152.45 39.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.178 1.391 . . . . 0.0 109.196 -171.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.74 101.79 6.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.5 mt -107.82 102.13 13.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -74.37 103.19 4.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.239 -0.913 . . . . 0.0 109.933 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.3 t -96.17 -177.45 3.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.226 1.41 . . . . 0.0 108.562 168.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.16 158.74 42.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.915 0.864 . . . . 0.0 110.486 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.1 t -74.56 98.95 3.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 164.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 29.3 t -57.37 -15.4 6.39 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -172.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -95.54 -15.36 22.91 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 117.55 -1.214 . . . . 0.0 114.051 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -129.4 1.05 5.08 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 120.588 1.54 . . . . 0.0 114.134 175.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t0 52.43 22.56 2.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 128.349 2.659 . . . . 0.0 113.423 -171.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.45 143.28 38.64 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.92 118.58 14.95 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.071 2.148 . . . . 0.0 110.21 -173.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.0 mt -124.69 90.82 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-O 122.143 0.973 . . . . 0.0 108.78 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.33 100.8 0.86 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.575 1.15 . . . . 0.0 109.71 170.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 mt -79.82 73.47 6.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -69.09 102.16 1.58 Allowed 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.5 m -124.08 170.92 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 125.611 1.564 . . . . 0.0 108.908 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -120.91 99.49 6.54 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 t -150.89 156.24 40.81 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-O 120.896 0.379 . . . . 0.0 110.872 178.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -67.63 162.06 24.4 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.749 0.82 . . . . 0.0 111.68 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.85 65.95 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.522 1.129 . . . . 0.0 112.546 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -72.73 -37.05 67.88 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.13 0.572 . . . . 0.0 111.638 -171.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.43 -44.69 74.41 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.575 0.75 . . . . 0.0 109.767 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.44 -45.61 66.07 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 118.271 0.487 . . . . 0.0 110.365 170.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.86 76.0 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.617 0.767 . . . . 0.0 109.984 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.7 m -60.59 -47.01 88.07 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 124.005 0.922 . . . . 0.0 110.383 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.47 -35.71 46.27 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -171.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.12 -34.91 79.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -67.35 -50.75 58.6 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.549 0.613 . . . . 0.0 111.174 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.05 -41.63 96.95 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.596 0.635 . . . . 0.0 111.63 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -83.76 -11.94 56.4 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.041 0.536 . . . . 0.0 111.975 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.6 mt -83.79 -34.59 24.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.362 0.983 . . . . 0.0 111.105 162.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -66.06 -66.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.872 1.269 . . . . 0.0 111.078 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -153.53 -40.66 0.1 Allowed 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 -158.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.36 157.78 37.02 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.4 p -146.6 168.7 20.63 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.01 -1.056 . . . . 0.0 109.732 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -103.76 31.43 4.45 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.386 0.674 . . . . 0.0 111.0 -172.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.7 p -26.26 106.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.869 2.468 . . . . 0.0 112.734 -171.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.47 148.85 63.49 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.864 -162.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -61.99 -26.57 78.73 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.278 1.985 . . . . 0.0 112.712 -173.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -60.64 -56.36 22.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.143 170.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 70.4 m -63.65 -36.8 85.02 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 119.046 0.839 . . . . 0.0 111.629 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.63 72.18 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.136 0.88 . . . . 0.0 111.679 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 m -80.25 -46.75 15.72 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.254 1.022 . . . . 0.0 111.258 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -82.7 -26.18 32.28 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.646 0.778 . . . . 0.0 112.2 -170.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.252 1.234 1 C-N-CA 133.324 4.65 . . . . 0.0 110.3 178.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.581 0 CA-C-O 118.675 -0.679 . . . . 0.0 112.473 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -55.34 100.53 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.513 1.925 . . . . 0.0 112.332 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -128.42 137.62 51.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.826 1.25 . . . . 0.0 109.504 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 99.55 8.87 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.557 0.743 . . . . 0.0 109.697 174.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 71.0 mt -93.51 101.81 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.56 102.66 1.19 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.487 1.915 . . . . 0.0 109.338 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.8 t -110.23 -175.13 2.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.092 1.757 . . . . 0.0 109.75 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.86 153.89 37.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.619 1.168 . . . . 0.0 110.853 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.2 t -73.62 106.55 5.43 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.337 1.855 . . . . 0.0 108.116 169.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.0 t -57.48 -10.07 1.32 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.574 1.95 . . . . 0.0 114.372 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -114.49 -10.91 12.52 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.888 1.275 . . . . 0.0 114.346 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 p -132.61 -0.51 3.53 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.7 1.591 . . . . 0.0 114.487 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t0 52.38 23.96 2.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.0 2.52 . . . . 0.0 113.492 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.75 139.79 16.68 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.55 -1.82 . . . . 0.0 108.55 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.38 140.78 29.7 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 112.067 -162.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 mt -126.05 107.28 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -78.1 92.76 4.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.6 mt -71.5 82.74 0.81 Allowed 'General case' 0 C--N 1.344 0.327 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 m -75.68 95.34 3.39 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.04 168.22 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 124.857 1.263 . . . . 0.0 107.969 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -124.53 97.64 5.39 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 166.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 t -143.92 167.77 21.54 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.704 0.402 . . . . 0.0 111.175 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 53.7 m -87.57 168.77 12.76 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.782 -1.199 . . . . 0.0 110.458 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.36 -48.07 68.86 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.572 1.149 . . . . 0.0 112.906 -172.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.61 -50.26 65.71 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.728 -0.654 . . . . 0.0 109.976 -172.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -57.89 -43.72 86.25 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.28 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.57 -38.63 72.24 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.012 0.823 . . . . 0.0 111.58 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -44.65 64.66 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.691 1.196 . . . . 0.0 111.762 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 m -71.44 -41.73 69.09 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.974 1.309 . . . . 0.0 109.698 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.97 -38.1 64.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.36 -42.77 96.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.141 -1.023 . . . . 0.0 109.821 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -68.7 -35.88 77.74 Favored 'General case' 0 CA--C 1.504 -0.816 0 C-N-CA 118.003 -1.479 . . . . 0.0 111.916 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.8 mt -67.2 -40.55 86.48 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 118.667 -1.213 . . . . 0.0 110.52 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -72.19 -28.82 63.45 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.38 1.072 . . . . 0.0 111.308 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -71.78 -36.59 70.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.846 0.748 . . . . 0.0 111.292 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.8 t -71.3 -69.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.852 1.661 . . . . 0.0 111.936 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -150.98 -29.45 0.19 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 -158.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 166.72 16.47 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.568 0.699 . . . . 0.0 109.148 168.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.2 m -167.16 -178.37 4.1 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.439 1.896 . . . . 0.0 106.984 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.49 176.26 8.87 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.185 0.594 . . . . 0.0 110.127 -171.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.61 138.61 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 125.899 1.68 . . . . 0.0 107.693 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.9 p -80.06 154.11 74.94 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.882 0.473 . . . . 0.0 109.917 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.74 -26.96 60.24 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.54 2.16 . . . . 0.0 112.949 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.27 -61.94 2.06 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.121 0.969 . . . . 0.0 109.503 170.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 95.6 m -64.97 -34.97 79.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 118.822 -0.608 . . . . 0.0 112.277 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.31 -35.48 71.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.21 0.914 . . . . 0.0 111.43 172.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -80.61 -44.06 19.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.172 0.989 . . . . 0.0 111.248 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.52 -22.8 53.94 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.982 0.913 . . . . 0.0 112.506 -176.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 C-N-CA 130.257 3.423 . . . . 0.0 111.597 -173.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.257 63.0 tt0 . . . . . 0 CA--C 1.543 0.692 0 CA-C-O 122.343 1.068 . . . . 0.0 110.027 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.24 100.91 0.85 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 126.014 1.725 . . . . 0.0 109.075 170.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -99.08 170.48 8.67 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.258 0.349 . . . . 0.0 110.543 173.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -116.54 123.56 47.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 168.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.9 mt -126.41 103.97 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 125.437 1.495 . . . . 0.0 107.572 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.76 109.44 2.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.924 0.89 . . . . 0.0 109.277 168.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.5 m -105.55 177.42 4.86 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.095 0.958 . . . . 0.0 109.5 167.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -135.92 155.79 36.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.521 0.677 . . . . 0.0 112.253 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.403 ' HG ' ' HG ' ' A' ' 19' ' ' CYS . 47.5 t -76.73 111.52 12.33 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.584 1.153 . . . . 0.0 109.098 169.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.0 t -61.86 -13.28 22.96 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -80.17 -50.5 10.2 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.622 1.556 . . . . 0.0 110.252 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.403 ' HG ' ' HG ' ' A' ' 16' ' ' CYS . 28.9 p -116.34 0.45 12.83 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.462 -161.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.8 t0 52.07 29.35 6.25 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.339 2.256 . . . . 0.0 111.653 -173.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -64.75 133.25 37.71 Favored Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -77.22 103.31 7.08 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 128.221 2.608 . . . . 0.0 109.402 -170.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.5 mt -118.61 88.93 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 122.312 1.053 . . . . 0.0 108.651 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.13 99.8 0.71 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.562 1.545 . . . . 0.0 108.896 170.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -83.5 161.93 21.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 171.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.9 t -136.12 126.0 25.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 157.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.6 m -143.77 141.96 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 -172.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -108.89 113.24 25.98 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -172.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.0 t -148.85 152.67 36.88 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.9 m -53.85 142.48 23.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.536 -1.666 . . . . 0.0 107.984 163.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.17 -35.55 17.14 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 125.493 1.517 . . . . 0.0 113.71 -171.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.38 -62.44 1.76 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.204 1.402 . . . . 0.0 110.396 -176.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -71.09 -23.56 62.14 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 122.158 -0.339 . . . . 0.0 111.022 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 tp -65.67 -40.85 92.85 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -49.64 76.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.029 0.932 . . . . 0.0 109.66 171.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.4 m -56.75 -51.38 69.12 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.979 0.809 . . . . 0.0 111.265 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.5 pp -74.74 -33.01 62.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.952 0.796 . . . . 0.0 109.742 -169.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.38 -36.66 77.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -65.76 -39.68 91.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.34 0.656 . . . . 0.0 110.971 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.4 mt -58.42 -49.73 76.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.565 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -67.02 -28.44 68.24 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.88 -35.52 67.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.794 0.725 . . . . 0.0 111.111 173.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -80.27 -71.79 0.44 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.175 1.39 . . . . 0.0 111.673 -173.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.0 m -147.38 -30.16 0.33 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.155 0.982 . . . . 0.0 113.188 -158.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.1 tp -72.21 152.75 42.02 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.9 p -142.09 173.64 11.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.969 0.907 . . . . 0.0 108.972 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -117.42 74.9 0.95 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -172.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -65.14 110.02 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.4 p -57.7 150.35 47.5 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 123.063 0.545 . . . . 0.0 110.968 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.26 -23.79 65.75 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.44 2.093 . . . . 0.0 112.615 -175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -57.14 -55.42 34.99 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.861 0.864 . . . . 0.0 110.626 168.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 61.9 m -68.66 -29.93 68.51 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.78 0.832 . . . . 0.0 112.713 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.78 -43.85 97.71 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.163 0.892 . . . . 0.0 110.846 169.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.4 m -72.06 -45.53 60.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.562 1.145 . . . . 0.0 111.246 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -72.66 -23.52 60.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.023 0.529 . . . . 0.0 111.02 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 127.325 2.25 . . . . 0.0 110.723 176.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 N--CA 1.451 -0.392 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.4 105.61 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.404 0.681 . . . . 0.0 109.47 162.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -131.19 132.03 44.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.797 1.639 . . . . 0.0 110.053 -175.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -104.62 95.84 6.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.5 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 mt -97.13 98.14 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 -171.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' GLU . 1.2 tt -62.95 101.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.476 1.11 . . . . 0.0 110.445 177.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.4 m -104.23 -177.59 3.41 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.4 0.28 . . . . 0.0 111.349 176.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.45 155.39 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 O-C-N 120.953 -1.092 . . . . 0.0 111.147 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.3 t -70.94 120.42 16.48 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.879 1.272 . . . . 0.0 108.982 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.0 t -57.42 -25.8 60.15 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.202 1.401 . . . . 0.0 113.402 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -90.29 -48.31 7.22 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.001 0.818 . . . . 0.0 111.176 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.7 p -113.92 0.9 14.55 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.797 0.839 . . . . 0.0 112.815 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.8 t70 58.77 21.11 8.59 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.787 2.035 . . . . 0.0 112.546 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.36 140.4 30.75 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -176.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -65.0 109.07 2.0 Allowed 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 127.155 2.182 . . . . 0.0 109.007 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.7 mm -96.75 151.69 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 162.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 13' ' ' LEU . 1.6 tt0 -134.59 115.9 14.39 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 120.009 -1.682 . . . . 0.0 108.379 161.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -79.37 85.66 5.16 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.2 m -71.56 74.75 0.79 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.369 0.986 . . . . 0.0 108.971 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.5 m -101.49 178.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 122.406 1.098 . . . . 0.0 109.317 -177.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.33 113.11 14.56 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 128.394 2.677 . . . . 0.0 104.434 172.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.7 m -157.77 125.18 5.16 Favored 'General case' 0 N--CA 1.437 -1.087 0 O-C-N 120.184 -1.572 . . . . 0.0 109.979 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -65.12 151.63 45.59 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.034 1.334 . . . . 0.0 110.267 -175.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -44.06 -49.12 8.9 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.316 1.447 . . . . 0.0 114.865 -170.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.33 -36.46 58.25 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 121.29 0.567 . . . . 0.0 110.973 -167.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -47.91 75.61 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.417 1.087 . . . . 0.0 109.599 168.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.12 -39.43 94.01 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 122.0 -0.438 . . . . 0.0 111.297 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -64.0 1.04 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 167.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.2 m -51.92 -44.16 63.73 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.869 0.759 . . . . 0.0 111.005 -170.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.19 -36.22 64.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.431 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.91 -34.09 76.69 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.199 175.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -32.34 66.56 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.626 0.648 . . . . 0.0 110.697 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.39 -49.4 77.07 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.083 0.856 . . . . 0.0 110.559 170.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.46 -42.15 98.33 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.514 0.597 . . . . 0.0 110.845 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 tp -59.85 -39.59 85.7 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.509 1.123 . . . . 0.0 111.401 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.8 t -72.98 -63.65 1.13 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.562 1.145 . . . . 0.0 111.501 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -160.19 -27.09 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -158.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 tp -70.67 156.96 38.81 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.443 1.019 . . . . 0.0 109.026 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -161.92 172.63 15.71 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 125.845 1.658 . . . . 0.0 106.647 170.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -116.04 178.07 4.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.128 0.971 . . . . 0.0 109.214 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.6 131.73 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -69.47 152.12 96.49 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -62.99 -26.31 74.02 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.18 1.92 . . . . 0.0 112.65 -176.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -59.62 -59.27 5.7 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.055 0.542 . . . . 0.0 109.872 169.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.8 m -60.28 -35.17 74.93 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.865 0.757 . . . . 0.0 112.204 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.96 96.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.857 0.753 . . . . 0.0 110.672 175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.2 m -75.24 -38.21 60.7 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.214 1.006 . . . . 0.0 111.555 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.86 -9.22 59.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.305 1.042 . . . . 0.0 111.915 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.414 10.4 pt20 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 128.953 2.901 . . . . 0.0 113.222 -171.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 . . . . . 0 N--CA 1.426 -1.647 0 N-CA-C 114.672 1.36 . . . . 0.0 114.672 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 ttm-85 -63.12 92.95 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 N-CA-C 115.281 1.585 . . . . 0.0 115.281 -166.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.0 m170 -118.98 150.03 40.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.174 -1.376 . . . . 0.0 109.051 -173.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -123.57 83.91 2.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mt -90.24 97.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 tt -70.87 93.04 0.94 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 123.563 0.745 . . . . 0.0 110.016 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.4 t -81.1 171.75 14.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.145 0.978 . . . . 0.0 108.427 167.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.0 m -121.67 156.88 25.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.623 0.725 . . . . 0.0 109.571 164.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.0 t -76.88 108.22 9.77 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.218 1.407 . . . . 0.0 108.151 169.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.28 -4.66 0.88 Allowed 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -172.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -111.34 -16.87 13.27 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 120.354 1.434 . . . . 0.0 114.798 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 26.7 p -126.44 0.73 6.95 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.439 1.472 . . . . 0.0 113.952 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.1 t70 56.1 20.02 4.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.195 2.198 . . . . 0.0 112.864 -169.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.48 140.86 31.32 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 120.939 -1.101 . . . . 0.0 110.4 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 122.55 18.73 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.784 2.034 . . . . 0.0 109.724 -173.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.6 mt -124.06 99.01 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -82.7 92.6 7.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.064 0.546 . . . . 0.0 109.549 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -77.04 89.18 3.57 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -176.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.6 m -67.29 97.88 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.2 127.59 51.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 122.211 1.005 . . . . 0.0 110.204 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.88 92.35 7.77 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.7 p -132.68 142.99 49.34 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 127.313 2.245 . . . . 0.0 108.28 -158.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -83.53 -81.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 120.544 1.52 . . . . 0.0 112.393 -159.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -165.68 -61.42 0.03 OUTLIER 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.23 -40.89 70.8 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.038 1.335 . . . . 0.0 109.058 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -49.05 76.44 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.002 1.321 . . . . 0.0 109.953 171.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.57 -46.68 86.39 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.011 0.524 . . . . 0.0 110.185 178.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.72 -55.39 34.98 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.0 m -58.28 -47.84 82.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.494 -173.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -65.35 -35.15 80.09 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.329 0.513 . . . . 0.0 110.759 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.51 -43.42 98.89 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 175.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -61.71 -47.45 85.2 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.102 0.864 . . . . 0.0 109.413 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.73 -44.04 97.15 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.291 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -74.95 -24.49 58.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.489 0.716 . . . . 0.0 110.887 -175.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.46 -36.69 45.0 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.455 0.702 . . . . 0.0 111.047 169.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 t -69.01 -67.43 0.47 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.798 1.239 . . . . 0.0 111.662 -173.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.46 -41.36 0.09 Allowed 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -158.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 tp -69.68 150.01 47.44 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -143.78 167.23 22.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 124.003 0.921 . . . . 0.0 109.038 166.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -95.3 -30.35 14.0 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -162.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.4 t 61.21 113.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 127.853 2.461 . . . . 0.0 111.916 -175.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.0 p -66.36 153.56 92.44 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 120.949 -1.094 . . . . 0.0 110.343 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.13 -24.57 66.1 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 122.399 2.066 . . . . 0.0 112.704 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -58.76 -53.55 57.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.172 0.589 . . . . 0.0 110.402 170.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.1 m -66.82 -36.32 82.08 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.661 175.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.53 -28.98 67.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.1 1.318 . . . . 0.0 112.029 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.0 m -82.28 -43.97 16.86 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.53 1.132 . . . . 0.0 111.303 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.83 -40.47 22.45 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.553 0.741 . . . . 0.0 112.01 -172.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 . . . . . 0 C--O 1.256 1.397 1 C-N-CA 134.139 4.975 . . . . 0.0 112.07 172.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.297 0.9 OUTLIER . . . . . 0 N--CA 1.44 -0.929 0 CA-C-O 116.739 -1.6 . . . . 0.0 111.259 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -51.29 103.45 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.936 1.244 . . . . 0.0 111.637 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -125.93 138.18 53.75 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -119.63 82.49 1.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.772 0.829 . . . . 0.0 108.91 -173.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.5 mt -90.35 101.25 12.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 -171.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 tt -74.82 87.07 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.326 1.05 . . . . 0.0 110.068 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.8 t -80.02 -171.5 2.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.178 1.391 . . . . 0.0 108.846 159.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 m -139.67 164.93 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 121.153 -0.967 . . . . 0.0 111.177 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.87 112.91 5.18 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 166.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -58.51 -18.96 33.31 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.917 0.887 . . . . 0.0 113.34 -171.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -109.01 -14.75 14.49 Favored 'General case' 0 C--N 1.345 0.389 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -128.33 2.28 5.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.644 1.565 . . . . 0.0 114.054 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 57.72 20.32 6.32 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.234 1.814 . . . . 0.0 112.989 -174.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.45 150.85 52.09 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 121.082 -1.011 . . . . 0.0 110.633 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.407 ' CG ' HH11 ' A' ' 22' ' ' ARG . 0.0 OUTLIER -66.51 112.01 3.88 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.705 2.002 . . . . 0.0 108.833 -172.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.0 mm -121.64 85.61 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 123.369 1.557 . . . . 0.0 108.05 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.82 121.24 15.04 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.443 159.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.1 mt -86.39 75.96 9.72 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 161.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.3 m -73.77 94.88 2.31 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 165.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.67 175.55 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.829 1.651 . . . . 0.0 108.45 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -120.47 119.87 34.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 162.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -143.25 169.01 18.43 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.639 1.176 . . . . 0.0 109.491 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 m -95.94 175.46 6.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 159.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.14 79.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.405 0.682 . . . . 0.0 111.958 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.09 -40.05 82.71 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.198 0.999 . . . . 0.0 110.764 -178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -63.51 -47.91 79.74 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.378 1.471 . . . . 0.0 109.404 173.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.83 -46.62 81.57 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.675 0.79 . . . . 0.0 109.962 175.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.0 ttt180 -59.88 -52.25 66.22 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.7 m -56.91 -52.23 65.98 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.241 1.016 . . . . 0.0 111.117 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.93 -31.49 72.69 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -63.16 -44.5 95.29 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 118.323 -0.846 . . . . 0.0 109.354 172.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.32 -46.1 89.51 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.523 1.056 . . . . 0.0 110.311 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -46.87 80.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.291 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -65.73 -26.59 67.81 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.795 0.685 . . . . 0.0 112.563 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -75.67 -33.87 60.43 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.317 1.847 . . . . 0.0 111.168 172.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -75.68 -67.37 0.67 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.112 0.965 . . . . 0.0 111.23 -172.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -157.76 -36.38 0.07 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.851 1.261 . . . . 0.0 112.515 -158.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.21 154.01 40.96 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.8 p -144.3 168.37 20.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.536 1.134 . . . . 0.0 108.189 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -91.5 -57.02 2.9 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 123.328 0.393 . . . . 0.0 110.665 -176.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t 67.85 134.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.714 2.406 . . . . 0.0 110.338 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.8 p -71.44 149.55 93.76 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.686 -1.259 . . . . 0.0 109.164 174.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.12 -25.48 65.67 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.316 2.01 . . . . 0.0 113.087 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -66.61 -37.92 85.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.936 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.3 m -76.29 -27.35 56.6 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 112.024 170.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.66 74.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.957 1.708 . . . . 0.0 110.718 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.2 m -76.63 -62.5 1.61 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.139 0.976 . . . . 0.0 111.219 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -83.9 -23.71 31.1 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -167.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 . . . . . 0 C--O 1.246 0.877 0 C-N-CA 128.402 2.681 . . . . 0.0 113.449 177.822 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 . . . . . 0 CA--C 1.539 0.55 0 CA-C-O 123.156 1.455 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.59 108.04 0.21 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 126.539 1.936 . . . . 0.0 110.804 166.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -125.97 166.37 17.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 125.097 1.359 . . . . 0.0 110.303 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.46 89.27 3.01 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.7 mt -78.98 94.65 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.24 103.31 1.55 Allowed 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 121.221 -0.925 . . . . 0.0 109.255 170.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t -104.71 179.01 4.4 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.897 0.879 . . . . 0.0 108.865 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.1 m -134.25 153.94 36.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-O 121.747 0.784 . . . . 0.0 111.027 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 21' ' ' GLY . 42.6 t -73.88 115.13 12.96 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.359 1.464 . . . . 0.0 109.818 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 t -59.7 -13.34 9.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.551 1.54 . . . . 0.0 113.905 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -115.7 -11.24 11.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.7 p -136.09 1.86 2.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.943 1.701 . . . . 0.0 114.855 174.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 55.55 20.79 4.0 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 127.477 2.311 . . . . 0.0 113.5 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.428 ' H ' ' HB3' ' A' ' 16' ' ' CYS . . . -71.92 140.88 30.8 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 120.823 -1.173 . . . . 0.0 110.265 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -69.43 123.46 21.29 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.673 1.989 . . . . 0.0 109.391 -175.466 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.5 mp -119.61 106.49 19.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 164.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.474 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 41.2 tt0 -81.38 90.42 6.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.5 mt -70.2 86.42 0.57 Allowed 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.4 m -70.09 101.37 1.81 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.2 m -136.61 139.58 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.091 0.956 . . . . 0.0 108.617 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.5 mp0 -95.58 91.27 6.06 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.23 -2.137 . . . . 0.0 105.23 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.1 p -132.65 120.26 21.51 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 124.57 1.148 . . . . 0.0 109.872 -166.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -57.81 148.13 26.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.72 1.263 . . . . 0.0 109.452 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -50.9 -40.59 57.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.869 0.867 . . . . 0.0 113.042 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.9 -45.32 82.41 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.342 1.057 . . . . 0.0 111.764 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.75 -54.85 41.46 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tt -52.43 -48.63 65.64 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.039 0.936 . . . . 0.0 110.584 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -57.05 -48.09 79.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.679 0.791 . . . . 0.0 109.695 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -56.45 -50.12 72.62 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.604 0.762 . . . . 0.0 110.43 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.46 -43.7 71.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -67.5 -36.29 80.79 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.318 -169.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -62.04 -46.51 88.82 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 123.748 0.819 . . . . 0.0 109.634 173.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.03 -52.43 63.99 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 118.416 -0.802 . . . . 0.0 110.59 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -64.17 -29.23 70.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -70.67 -41.43 72.06 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.087 0.955 . . . . 0.0 111.251 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -70.15 -68.04 0.45 Allowed 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.727 1.611 . . . . 0.0 111.422 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -155.08 -34.19 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -158.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.1 tp -71.0 165.92 22.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.86 0.838 . . . . 0.0 109.154 175.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.5 m -159.38 -175.04 4.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -118.62 169.37 9.87 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.16 0.984 . . . . 0.0 108.712 -176.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.9 p -144.97 132.33 16.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.4 p -70.41 154.45 94.45 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.911 -0.566 . . . . 0.0 109.933 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -63.7 -31.59 69.19 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.243 1.962 . . . . 0.0 112.719 -174.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -56.55 -49.92 73.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.745 0.818 . . . . 0.0 110.397 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 m -68.86 -31.19 69.97 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.167 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.14 71.04 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.093 1.315 . . . . 0.0 111.513 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.99 -16.62 18.65 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -108.84 -31.25 7.76 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.562 1.073 . . . . 0.0 111.964 176.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.27 69.1 mt-30 . . . . . 0 C--O 1.255 1.361 0 C-N-CA 129.787 3.235 . . . . 0.0 115.883 176.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.21 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 t -150.94 176.55 11.0 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.0 m80 -134.99 110.69 9.25 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 124.791 1.237 . . . . 0.0 108.178 -171.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 28.3 tpp -153.13 98.67 2.31 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 105.256 -2.127 . . . . 0.0 105.256 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.483 ' H ' ' CD ' ' A' ' 6' ' ' GLU . . . -146.26 23.7 1.31 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.215 1.806 . . . . 0.0 114.238 -164.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' A' ' 5' ' ' ALA . 25.1 mp0 -86.13 156.88 57.28 Favored Pre-proline 0 C--N 1.326 -0.443 0 C-N-CA 122.795 0.438 . . . . 0.0 110.683 -161.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -65.76 169.82 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.283 1.989 . . . . 0.0 109.955 170.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 55.4 -67.52 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.896 0 C-N-CA 127.96 2.504 . . . . 0.0 112.686 -164.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -54.05 89.17 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.422 1.889 . . . . 0.0 112.204 -176.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -128.97 133.23 47.72 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.662 1.185 . . . . 0.0 108.748 -168.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.48 94.89 5.57 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.261 1.024 . . . . 0.0 109.327 -178.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.3 mt -96.41 98.66 7.91 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.134 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 -178.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.727 HD13 ' HD2' ' A' ' 22' ' ' ARG 0.391 0.2 OUTLIER -84.1 124.33 31.0 Favored 'General case' 0 N--CA 1.439 -0.99 0 O-C-N 120.816 -1.177 . . . . 0.0 111.688 -177.987 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 9.1 t -120.5 -154.94 0.6 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.284 2.234 . . . . 0.0 108.055 172.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.439 ' CG1' HH21 ' A' ' 22' ' ' ARG . 13.4 m -137.17 159.97 36.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 O-C-N 120.502 -1.374 . . . . 0.0 111.22 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 53.2 t -66.02 110.97 3.13 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 159.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -56.91 -11.51 1.5 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.617 1.967 . . . . 0.0 114.232 -174.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -121.21 -14.66 8.31 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 114.908 1.447 . . . . 0.0 114.908 -175.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -125.66 2.79 7.53 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 120.08 1.309 . . . . 0.0 113.778 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.3 t70 58.13 15.91 3.55 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.861 2.464 . . . . 0.0 113.678 -177.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.06 146.83 28.35 Favored Glycine 0 C--N 1.342 0.871 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -174.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.727 ' HD2' HD13 ' A' ' 13' ' ' LEU . 1.8 tpp85 -70.92 119.14 14.61 Favored 'General case' 0 N--CA 1.425 -1.703 0 C-N-CA 124.548 1.139 . . . . 0.0 110.573 -166.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 78.6 mt -109.26 100.11 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 169.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -71.29 97.18 1.53 Allowed 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 163.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.2 mt -71.69 82.92 0.87 Allowed 'General case' 0 C--N 1.348 0.503 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 87.0 m -69.97 102.17 1.95 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 168.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.8 m -118.55 172.94 5.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 C-N-CA 124.676 1.19 . . . . 0.0 108.619 177.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -120.98 92.91 3.86 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 165.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 m -133.31 131.08 39.74 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.789 0.835 . . . . 0.0 109.118 -170.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.7 m -62.53 162.21 10.73 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -51.79 -42.4 62.41 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 122.904 0.482 . . . . 0.0 112.254 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -75.19 -33.98 61.49 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -174.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -67.09 -45.66 76.6 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 123.37 0.668 . . . . 0.0 109.421 171.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 tt -57.97 -44.0 86.81 Favored 'General case' 0 C--N 1.34 0.195 0 C-N-CA 123.567 0.747 . . . . 0.0 110.158 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.6 ttt180 -62.79 -53.43 54.42 Favored 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 124.807 1.243 . . . . 0.0 109.392 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 48.6 m -59.05 -51.13 71.38 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.788 0.835 . . . . 0.0 109.984 -175.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.16 -28.46 68.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 118.582 -0.723 . . . . 0.0 110.583 178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -50.87 69.38 Favored 'General case' 0 C--N 1.346 0.424 0 CA-C-N 118.826 0.739 . . . . 0.0 109.326 170.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -62.54 -41.05 98.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -175.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.91 -49.13 77.42 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.678 -0.677 . . . . 0.0 111.172 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.36 -34.07 77.13 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.352 0.524 . . . . 0.0 111.635 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.0 tt -66.61 -38.67 87.45 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.191 0.996 . . . . 0.0 110.816 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.8 t -70.88 -67.57 0.5 Allowed 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.331 1.452 . . . . 0.0 111.452 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.2 p -153.89 -36.63 0.1 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 -158.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.1 tp -66.12 148.0 52.48 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.524 0.678 . . . . 0.0 109.604 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.8 m -160.5 168.14 25.72 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 166.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.6 m-30 -121.02 174.02 6.89 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.853 1.661 . . . . 0.0 107.881 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 17.0 m -133.22 148.1 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 C-N-CA 126.588 1.955 . . . . 0.0 108.164 175.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.6 p -75.28 157.04 85.32 Favored Pre-proline 0 CA--C 1.539 0.52 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -64.2 -27.0 64.45 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.188 1.925 . . . . 0.0 113.128 -174.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 43.0 t90 -58.5 -59.88 4.68 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 123.008 0.523 . . . . 0.0 109.767 170.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 86.2 m -58.77 -42.86 89.96 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 118.775 -0.631 . . . . 0.0 110.799 177.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.8 -31.44 68.43 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 119.137 0.881 . . . . 0.0 112.409 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.1 m -79.68 -35.98 38.36 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.806 0.843 . . . . 0.0 111.241 176.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.77 -49.19 10.7 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 118.591 -0.719 . . . . 0.0 111.418 -174.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 . . . . . 0 C--O 1.25 1.109 1 C-N-CA 133.966 4.907 . . . . 0.0 108.961 -178.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.119 0 N-CA-C 107.563 -2.215 . . . . 0.0 107.563 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 t -65.23 161.27 19.67 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 118.375 -1.33 . . . . 0.0 107.531 137.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -144.28 97.8 3.1 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 125.167 1.387 . . . . 0.0 107.792 -175.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 32.8 ttp -149.9 34.93 0.68 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.136 1.374 . . . . 0.0 109.251 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -133.71 26.65 4.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 127.571 2.348 . . . . 0.0 110.726 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.0 mp0 -134.81 153.96 79.07 Favored Pre-proline 0 CA--C 1.538 0.483 0 C-N-CA 126.855 2.062 . . . . 0.0 108.003 -172.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.89 51.28 3.03 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.247 3.298 . . . . 0.0 110.751 174.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -136.34 -76.26 0.43 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.926 1.69 . . . . 0.0 108.742 -169.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.67 101.31 0.07 Allowed 'General case' 0 C--N 1.343 0.3 0 C-N-CA 125.229 1.412 . . . . 0.0 111.532 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -126.38 152.18 46.65 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 125.333 1.453 . . . . 0.0 109.125 -173.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -125.51 96.35 4.77 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 17.0 mt -97.31 97.76 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -171.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.88 102.34 0.77 Allowed 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 169.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 p -98.9 -172.27 2.26 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 162.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -130.7 151.69 36.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 CA-C-O 121.779 0.8 . . . . 0.0 110.565 174.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -70.27 106.38 3.32 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 126.283 1.833 . . . . 0.0 108.335 162.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.4 t -59.9 -8.73 2.38 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.912 1.685 . . . . 0.0 114.141 -174.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -114.1 -14.74 12.34 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.9 p -122.09 -0.82 9.38 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.005 1.275 . . . . 0.0 113.307 170.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.8 t0 50.97 23.33 1.44 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 127.514 2.325 . . . . 0.0 112.782 -169.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.63 137.46 18.16 Favored Glycine 0 C--N 1.338 0.675 0 N-CA-C 108.835 -1.706 . . . . 0.0 108.835 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -76.42 139.12 40.77 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.231 -0.984 . . . . 0.0 109.807 -170.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 23.0 mt -130.42 98.62 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 86.9 tt0 -72.8 87.89 1.3 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.502 1.521 . . . . 0.0 109.552 175.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.0 mt -70.22 86.68 0.58 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.845 0.858 . . . . 0.0 108.79 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.3 m -72.2 105.25 3.93 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 169.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.6 m -124.28 173.49 10.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 125.365 1.466 . . . . 0.0 109.204 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -125.11 99.76 6.25 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 168.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -157.95 130.26 7.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 O-C-N 120.693 -1.255 . . . . 0.0 108.634 -164.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.6 m -65.67 165.77 11.93 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 -158.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.42 -49.0 46.89 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.193 1.397 . . . . 0.0 113.635 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.14 -50.84 62.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -175.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -54.56 -44.79 73.23 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.874 0.87 . . . . 0.0 110.543 175.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.48 -48.68 76.61 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.259 0.624 . . . . 0.0 110.662 174.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.15 -53.93 48.35 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.3 m -58.97 -49.87 76.24 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 124.162 0.985 . . . . 0.0 110.467 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.91 -32.72 74.56 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.32 0.964 . . . . 0.0 111.493 176.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -57.86 -45.84 85.7 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 173.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -60.19 -42.05 94.21 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 118.909 0.777 . . . . 0.0 110.364 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.9 mt -59.48 -49.96 75.75 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.109 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -65.97 -33.36 75.64 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.174 0.443 . . . . 0.0 111.61 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.26 -38.59 90.79 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.829 0.74 . . . . 0.0 111.391 172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 t -74.31 -58.94 2.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.63 1.172 . . . . 0.0 111.168 -174.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 54.1 m -163.37 -23.24 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 -171.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.8 tp -64.45 142.97 58.24 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 120.074 1.307 . . . . 0.0 110.056 -173.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.3 m -155.79 166.72 32.64 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 165.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -119.77 -172.88 2.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 -165.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -144.52 126.86 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 N-CA-C 106.109 -1.811 . . . . 0.0 106.109 174.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 8.4 p -68.73 150.32 97.67 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.93 -28.66 66.87 Favored 'Trans proline' 0 CA--C 1.535 0.531 0 C-N-CA 122.143 1.895 . . . . 0.0 113.523 -169.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -61.44 -49.82 75.29 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 122.808 0.443 . . . . 0.0 110.792 171.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 62.6 m -68.15 -32.78 73.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.618 -0.706 . . . . 0.0 111.842 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.01 -32.08 73.63 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 120.012 1.278 . . . . 0.0 111.437 173.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 38.8 m -76.48 -49.74 15.81 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.428 1.091 . . . . 0.0 110.928 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 18.1 m-80 -85.69 -16.72 38.14 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.767 0.827 . . . . 0.0 112.544 -173.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 . . . . . 0 C--O 1.254 1.34 0 C-N-CA 131.038 3.735 . . . . 0.0 114.956 -177.985 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.277 0 N-CA-C 110.163 -1.175 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.5 t 59.48 14.25 3.74 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -135.44 76.78 1.64 Allowed 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 175.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.7 ptm -174.4 175.45 2.59 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 127.759 2.424 . . . . 0.0 106.766 -166.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 63.87 24.15 13.62 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.522 1.529 . . . . 0.0 114.223 172.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -78.5 161.31 70.23 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.237 -167.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -64.1 169.18 11.01 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.053 1.836 . . . . 0.0 110.28 165.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.258 0.0 OUTLIER 64.64 -73.56 0.05 Allowed 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.184 1.794 . . . . 0.0 111.22 -170.545 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -53.3 92.11 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.478 2.311 . . . . 0.0 112.586 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -126.47 160.92 29.16 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.138 0.975 . . . . 0.0 110.167 -175.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -133.45 98.09 4.13 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.275 -0.89 . . . . 0.0 110.254 -168.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.2 mm -86.95 100.22 9.51 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -177.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.519 HD21 ' HD3' ' A' ' 22' ' ' ARG . 0.3 OUTLIER -66.83 86.75 0.13 Allowed 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 124.108 0.963 . . . . 0.0 109.68 173.756 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 33.4 t -89.26 176.73 6.83 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.332 1.453 . . . . 0.0 110.018 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -123.75 158.48 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 C-N-CA 124.322 1.049 . . . . 0.0 110.318 163.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -73.99 115.16 13.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.637 1.975 . . . . 0.0 109.351 169.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.5 t -55.95 -24.44 38.25 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.066 1.746 . . . . 0.0 113.977 -173.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.44 -41.87 9.57 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.88 1.218 . . . . 0.0 112.723 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.4 p -110.93 -3.64 15.53 Favored 'General case' 0 CA--C 1.529 0.17 0 N-CA-C 113.08 0.77 . . . . 0.0 113.08 -167.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.7 t0 49.8 38.53 15.93 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.691 1.996 . . . . 0.0 112.054 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -99.2 144.86 17.37 Favored Glycine 0 C--N 1.341 0.829 0 N-CA-C 107.864 -2.094 . . . . 0.0 107.864 170.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.519 ' HD3' HD21 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -81.5 149.62 28.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.909 -165.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.94 108.46 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -80.31 91.9 5.7 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.791 0.836 . . . . 0.0 108.762 177.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -74.81 87.16 2.24 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 -176.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -71.45 95.68 1.4 Allowed 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 171.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.5 m -104.62 172.57 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.383 1.473 . . . . 0.0 109.503 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -123.57 107.47 11.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 106.217 -1.771 . . . . 0.0 106.217 160.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.3 t -151.17 169.19 22.48 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.998 0.519 . . . . 0.0 109.808 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 50.6 m -82.34 170.28 15.52 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.555 -1.341 . . . . 0.0 110.643 -177.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.31 -33.03 74.42 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.186 0.594 . . . . 0.0 111.285 -174.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 32' ' ' GLU . 1.7 mp0 -62.3 -52.73 62.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 126.76 2.024 . . . . 0.0 109.918 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.88 -46.74 77.26 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.486 1.114 . . . . 0.0 109.818 177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.1 tt -52.96 -47.19 68.32 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.119 0.418 . . . . 0.0 111.065 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -64.72 -49.65 70.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 27.4 m -58.69 -50.12 75.04 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 122.445 0.298 . . . . 0.0 110.365 -176.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 pp -66.89 -31.94 72.87 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 118.727 -0.654 . . . . 0.0 110.875 179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.23 -41.97 89.92 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 119.611 1.096 . . . . 0.0 108.724 172.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -63.67 -43.6 96.22 Favored 'General case' 0 C--N 1.343 0.313 0 CA-C-N 119.264 0.938 . . . . 0.0 110.313 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.42 -42.7 99.15 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.261 0.482 . . . . 0.0 112.002 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -73.89 -30.82 62.83 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 122.788 0.435 . . . . 0.0 111.231 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 44.3 mt -69.44 -35.61 75.85 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.923 0.783 . . . . 0.0 111.131 170.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.3 t -67.58 -68.9 0.35 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.461 1.505 . . . . 0.0 110.935 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.71 -36.65 0.1 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -158.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.8 tp -70.14 153.0 43.67 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.481 0.658 . . . . 0.0 109.76 -178.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.5 m -165.79 167.87 16.54 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 126.017 1.727 . . . . 0.0 107.126 170.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -115.97 -179.72 3.74 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 125.214 1.405 . . . . 0.0 108.854 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -134.48 132.66 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 126.766 2.027 . . . . 0.0 105.856 -178.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.1 p -70.14 151.52 95.96 Favored Pre-proline 0 CA--C 1.537 0.463 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -62.03 -30.95 83.64 Favored 'Trans proline' 0 N--CA 1.46 -0.498 0 C-N-CA 121.929 1.752 . . . . 0.0 112.125 -175.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 68.7 t-105 -56.89 -48.68 77.63 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.287 0.494 . . . . 0.0 111.066 171.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.1 m -69.69 -28.32 65.74 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-O 118.278 -0.867 . . . . 0.0 112.413 176.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.22 -47.65 81.59 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.378 0.99 . . . . 0.0 110.213 170.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 53.8 m -65.55 -47.94 74.13 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.868 0.867 . . . . 0.0 112.006 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.62 -24.0 59.97 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 118.276 0.489 . . . . 0.0 111.669 -176.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 127.596 2.358 . . . . 0.0 112.621 170.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.107 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 t 57.2 -169.67 0.1 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.895 0.878 . . . . 0.0 111.419 -165.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -148.56 -176.87 5.48 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 128.72 2.808 . . . . 0.0 107.826 177.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 39.1 tpp -132.14 155.44 48.16 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.653 1.181 . . . . 0.0 108.574 173.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -85.32 69.2 10.7 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.592 1.557 . . . . 0.0 109.14 171.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' CD ' HH21 ' A' ' 9' ' ' ARG . 14.9 mt-10 -72.94 138.87 79.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 118.849 -0.596 . . . . 0.0 110.682 -168.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -79.11 37.9 0.69 Allowed 'Trans proline' 0 CA--C 1.538 0.707 0 C-N-CA 125.159 3.906 . . . . 0.0 111.468 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -140.39 -72.33 0.36 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.831 2.052 . . . . 0.0 107.576 -176.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.417 HH21 ' CD ' ' A' ' 6' ' ' GLU . 26.3 ttm-85 -64.59 101.68 0.48 Allowed 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.656 1.582 . . . . 0.0 112.73 -172.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -135.48 109.98 8.52 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.152 -1.386 . . . . 0.0 109.989 -159.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -87.11 110.89 20.42 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 124.91 1.284 . . . . 0.0 108.837 -174.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 85.0 mt -112.08 98.47 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 176.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.87 110.72 2.97 Favored 'General case' 0 N--CA 1.447 -0.606 0 O-C-N 121.485 -0.759 . . . . 0.0 109.218 173.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.9 t -109.65 -179.21 3.75 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.407 0.683 . . . . 0.0 109.98 168.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.3 m -136.95 153.29 29.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 CA-C-O 122.051 0.929 . . . . 0.0 112.022 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.408 ' SG ' ' HA ' ' A' ' 48' ' ' VAL . 45.4 t -65.38 119.37 10.86 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.675 163.287 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.4 t -56.52 -18.67 12.36 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.29 1.436 . . . . 0.0 114.657 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HE3' ' SG ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -125.28 -16.92 5.8 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -164.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.9 p -121.71 0.63 9.87 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.816 0.846 . . . . 0.0 113.072 169.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 24.7 t70 56.59 19.85 4.52 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 126.302 1.841 . . . . 0.0 112.647 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.0 131.46 36.41 Favored Glycine 0 C--N 1.34 0.782 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -175.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -71.88 114.67 10.22 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 127.286 2.234 . . . . 0.0 109.621 -169.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.1 mm -110.15 134.57 51.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -105.91 93.28 4.55 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 174.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 18.5 mt -79.68 82.49 5.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . 0.339 5.7 t -73.62 103.52 4.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 117.514 -1.674 . . . . 0.0 108.674 161.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.4 m -79.73 172.02 1.19 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.557 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 158.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -126.61 93.71 3.86 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 104.991 -2.226 . . . . 0.0 104.991 160.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.2 t -158.05 171.73 19.71 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 122.67 0.388 . . . . 0.0 111.256 -167.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 13.1 t -68.47 166.7 16.32 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.852 0.834 . . . . 0.0 111.678 -178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.34 -32.72 72.61 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.951 1.3 . . . . 0.0 111.369 167.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -68.14 -48.79 64.4 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.025 0.93 . . . . 0.0 110.057 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -67.94 -46.27 71.94 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.802 1.241 . . . . 0.0 109.865 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 tt -48.91 -51.61 29.09 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-N 118.348 0.522 . . . . 0.0 110.271 170.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -59.93 -55.86 28.88 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 -178.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 m -53.17 -53.04 56.34 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.193 0.997 . . . . 0.0 110.063 -174.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -34.85 79.21 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.058 -178.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -60.47 -46.86 88.53 Favored 'General case' 0 C--O 1.216 -0.66 0 CA-C-O 117.185 -1.388 . . . . 0.0 109.476 170.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.0 -46.36 82.35 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 121.128 1.785 . . . . 0.0 109.862 -177.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -70.45 -43.63 69.47 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -179.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.8 m-85 -67.44 -23.36 65.51 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.35 -34.18 48.58 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 126.262 1.825 . . . . 0.0 110.844 171.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.3 t -66.75 -67.54 0.44 Allowed 'General case' 0 C--N 1.339 0.152 0 C-N-CA 124.302 1.041 . . . . 0.0 110.287 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -157.52 -44.69 0.07 Allowed 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 123.775 0.83 . . . . 0.0 112.384 -158.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -58.01 139.09 55.25 Favored 'General case' 0 C--N 1.341 0.215 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -177.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -144.96 161.98 38.03 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -172.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -118.31 68.75 0.78 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 117.963 0.347 . . . . 0.0 110.919 -158.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.408 ' HA ' ' SG ' ' A' ' 16' ' ' CYS . 35.7 m -62.33 113.19 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 CA-C-O 121.64 0.733 . . . . 0.0 109.671 -177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 12.1 p -57.97 152.96 36.24 Favored Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 124.21 1.004 . . . . 0.0 110.317 -178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -63.72 -25.87 68.53 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 122.303 2.002 . . . . 0.0 113.096 -171.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 79.3 t90 -60.79 -53.32 58.81 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.292 0.497 . . . . 0.0 109.848 169.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.409 ' SG ' ' HE3' ' A' ' 18' ' ' LYS . 10.0 m -62.62 -36.74 83.76 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 118.66 -0.686 . . . . 0.0 111.919 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.9 -38.5 88.61 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.597 0.635 . . . . 0.0 111.296 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 m -74.06 -42.06 60.8 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.306 1.042 . . . . 0.0 111.402 -179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -86.67 -19.86 28.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.436 0.694 . . . . 0.0 112.336 -172.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 127.549 2.34 . . . . 0.0 111.156 -173.095 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.203 0 N-CA-C 110.146 -1.181 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.8 t -138.55 20.54 2.72 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.791 0.836 . . . . 0.0 112.048 -176.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -136.89 172.92 12.29 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 167.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.9 ttm -66.05 161.34 21.85 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.329 1.452 . . . . 0.0 110.904 -178.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -88.29 92.84 9.31 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 159.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -83.41 143.79 45.24 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-O 119.126 -0.464 . . . . 0.0 111.346 -159.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -78.82 46.5 2.19 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.144 3.896 . . . . 0.0 111.186 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -152.49 -66.74 0.16 Allowed 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -55.0 93.1 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 127.522 2.329 . . . . 0.0 111.478 172.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.6 m170 -125.29 143.97 50.7 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 124.888 1.275 . . . . 0.0 110.451 -168.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -114.57 82.19 1.68 Allowed 'General case' 0 C--N 1.344 0.368 0 C-N-CA 123.118 0.567 . . . . 0.0 109.711 -176.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 53.7 mt -83.82 100.91 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -72.56 100.06 2.67 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 120.928 -1.107 . . . . 0.0 109.778 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.45 -173.94 4.77 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 160.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -137.45 159.41 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 124.641 1.176 . . . . 0.0 110.01 173.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.27 113.28 9.14 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 126.769 2.028 . . . . 0.0 108.558 174.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 4.4 t -56.9 -18.65 14.03 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.17 1.788 . . . . 0.0 113.458 -174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.32 -16.19 13.0 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.0 p -129.9 -0.8 4.75 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.749 1.613 . . . . 0.0 114.475 177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.9 t0 55.1 24.06 5.8 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.556 1.943 . . . . 0.0 113.217 -174.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.56 146.37 28.61 Favored Glycine 0 C--N 1.34 0.78 0 N-CA-C 108.714 -1.754 . . . . 0.0 108.714 175.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.79 141.12 39.42 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.613 -166.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 26.4 mm -121.93 94.09 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 N-CA-C 106.557 -1.645 . . . . 0.0 106.557 -178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -74.25 95.46 2.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.946 -1.025 . . . . 0.0 109.321 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.0 mt -78.94 74.06 5.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 173.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.3 m -75.39 96.65 3.46 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 167.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.92 157.48 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 C-N-CA 126.143 1.777 . . . . 0.0 108.589 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -104.82 102.59 12.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 -178.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.1 t -151.97 156.73 40.61 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 118.057 0.39 . . . . 0.0 110.283 173.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 45.3 m -67.68 163.33 21.72 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.234 0.614 . . . . 0.0 111.928 -174.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -60.61 -34.89 74.91 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.643 0.777 . . . . 0.0 111.329 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -61.65 -48.92 78.65 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 126.323 1.849 . . . . 0.0 110.547 178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -69.18 -46.99 66.13 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.949 0.9 . . . . 0.0 109.857 178.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 tt -50.12 -46.14 53.51 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.285 0.634 . . . . 0.0 110.881 173.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -66.22 -51.79 54.23 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.8 0.84 . . . . 0.0 109.416 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 43.6 m -58.05 -51.99 67.39 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 123.997 0.919 . . . . 0.0 110.078 -176.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.67 -31.44 72.66 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.138 177.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.39 -51.68 61.78 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.296 0.953 . . . . 0.0 108.871 170.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.8 mm-40 -59.65 -43.77 93.79 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.6 mt -59.31 -47.2 86.28 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.164 0.438 . . . . 0.0 112.053 177.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -71.86 -25.74 62.07 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.034 0.534 . . . . 0.0 112.315 179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.97 -43.26 75.33 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.389 0.995 . . . . 0.0 110.561 166.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.7 t -66.85 -54.89 17.81 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.747 1.219 . . . . 0.0 111.22 -172.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 83.2 m -160.25 -27.18 0.06 Allowed 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.841 1.052 . . . . 0.0 113.841 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.18 156.78 38.14 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 120.027 1.285 . . . . 0.0 110.685 -171.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.1 m -164.96 171.24 14.26 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 125.744 1.617 . . . . 0.0 108.35 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -128.38 -179.95 5.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.738 1.215 . . . . 0.0 109.425 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.3 p -147.07 136.83 16.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 125.613 1.565 . . . . 0.0 107.146 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.6 p -72.78 154.58 91.17 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-O 119.147 -0.454 . . . . 0.0 109.947 176.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.9 -27.54 58.78 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 122.34 2.027 . . . . 0.0 112.819 -177.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 55.4 t90 -58.25 -57.62 12.07 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.063 0.545 . . . . 0.0 109.54 169.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 m -59.76 -39.5 85.04 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.633 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.57 -34.49 72.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.537 1.062 . . . . 0.0 111.4 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.7 m -76.82 -31.83 57.19 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.455 1.102 . . . . 0.0 111.782 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -94.98 -6.71 41.75 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.272 1.029 . . . . 0.0 112.705 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.322 14.8 pt20 . . . . . 0 C--O 1.252 1.187 0 C-N-CA 129.581 3.152 . . . . 0.0 113.856 -171.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.281 0 N-CA-C 110.283 -1.127 . . . . 0.0 110.283 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.2 t 58.6 13.89 2.81 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -87.77 153.95 20.94 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.013 0.925 . . . . 0.0 109.121 172.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 21.7 ttt -147.79 148.93 31.46 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 106.319 -1.734 . . . . 0.0 106.319 167.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 121.92 28.21 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 1 C-N-CA 131.937 4.095 . . . . 0.0 111.317 -170.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.68 143.08 50.09 Favored Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 123.672 0.789 . . . . 0.0 110.838 -158.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -69.8 103.6 1.19 Allowed 'Trans proline' 0 N--CA 1.458 -0.565 0 C-N-CA 123.43 2.753 . . . . 0.0 111.439 -163.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 42.64 58.25 3.2 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.644 1.978 . . . . 0.0 113.483 -177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -66.12 88.48 0.12 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 110.743 -2.935 . . . . 0.0 108.246 167.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.8 m170 -105.26 173.61 6.23 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.564 1.946 . . . . 0.0 110.683 -175.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.22 93.72 3.64 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 125.345 1.458 . . . . 0.0 107.77 175.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.7 mt -95.09 100.31 10.83 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 -173.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.8 tt -66.69 112.06 4.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 123.763 0.825 . . . . 0.0 109.453 175.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 p -108.54 -169.91 1.58 Allowed 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.125 0.57 . . . . 0.0 110.35 160.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.7 m -125.08 165.75 21.83 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 C-N-CA 122.94 0.496 . . . . 0.0 109.85 165.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.5 t -68.16 124.19 22.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 125.123 1.369 . . . . 0.0 107.653 160.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 6.6 t -63.87 -7.05 6.98 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -172.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.2 ptpt -137.72 -8.68 1.64 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 115.842 1.794 . . . . 0.0 115.842 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.6 p -128.75 1.58 5.44 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.883 1.273 . . . . 0.0 110.469 167.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.73 29.55 9.71 Favored 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 128.301 2.64 . . . . 0.0 112.49 176.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.49 141.95 25.32 Favored Glycine 0 C--N 1.339 0.701 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -71.51 120.7 17.46 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 126.766 2.026 . . . . 0.0 110.586 -170.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.1 mt -122.53 106.98 18.58 Favored 'Isoleucine or valine' 0 C--N 1.346 0.428 0 CA-C-N 119.928 1.24 . . . . 0.0 108.175 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -79.86 92.46 5.5 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.832 0.853 . . . . 0.0 109.362 173.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.4 mt -69.45 90.18 0.52 Allowed 'General case' 0 C--N 1.341 0.221 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.1 m -74.88 100.37 4.07 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 172.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.0 m -142.72 154.2 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.135 0 C-N-CA 124.421 1.089 . . . . 0.0 109.325 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -113.8 110.11 19.62 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 -174.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.2 m -155.15 112.6 3.35 Favored 'General case' 0 N--CA 1.435 -1.175 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -160.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 75.4 m -71.13 156.48 39.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 113.596 -1.638 . . . . 0.0 109.978 -169.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.96 -38.48 62.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.353 1.242 . . . . 0.0 114.353 -166.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.95 -56.2 9.91 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.722 1.209 . . . . 0.0 110.664 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -56.97 -38.04 72.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 126.355 1.862 . . . . 0.0 111.402 175.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 52.4 tp -64.22 -42.95 96.37 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.381 1.472 . . . . 0.0 109.174 175.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.92 -42.51 98.25 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.314 0.646 . . . . 0.0 110.367 173.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.6 m -60.96 -54.47 44.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.757 0.708 . . . . 0.0 110.196 175.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.42 -29.64 68.35 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 118.989 0.813 . . . . 0.0 111.891 -175.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -55.74 -51.4 67.49 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 125.72 1.608 . . . . 0.0 108.183 168.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -70.63 -33.38 70.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.013 0.525 . . . . 0.0 111.102 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.1 mt -62.13 -50.48 71.72 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.53 170.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -62.94 -34.63 77.88 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.801 0.728 . . . . 0.0 111.446 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 tt -68.62 -37.78 80.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 0.0 110.711 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 t -70.83 -69.34 0.37 Allowed 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.575 1.55 . . . . 0.0 111.796 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -154.9 -32.08 0.1 Allowed 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -158.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.7 tp -64.09 129.12 38.73 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.355 0.662 . . . . 0.0 109.531 -176.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -133.87 166.5 22.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 168.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -122.89 167.45 13.54 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.271 1.428 . . . . 0.0 107.961 -174.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 43.2 t -140.13 132.67 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -174.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.8 p -69.31 153.43 95.9 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.6 -28.93 69.87 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.096 1.864 . . . . 0.0 113.086 -172.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -59.72 -60.31 4.04 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.521 0.601 . . . . 0.0 109.71 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 20.5 m -54.96 -43.8 73.8 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.902 177.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.37 -35.57 74.15 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.812 0.733 . . . . 0.0 111.997 178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.37 -25.15 39.32 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.345 1.058 . . . . 0.0 112.007 178.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -104.75 -12.27 16.41 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.614 0.765 . . . . 0.0 112.841 -171.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.261 0.0 OUTLIER . . . . . 0 C--O 1.252 1.189 0 CA-C-O 116.925 -1.512 . . . . 0.0 112.869 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.272 0 N-CA-C 110.251 -1.14 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t 54.2 37.48 27.29 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.074 0.95 . . . . 0.0 112.583 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.2 m170 -71.26 77.12 0.72 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.762 1.225 . . . . 0.0 110.195 -178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 46.6 tpp -139.43 114.11 9.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 124.319 1.047 . . . . 0.0 109.599 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -148.32 140.24 23.91 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 159.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -131.32 156.58 79.93 Favored Pre-proline 0 C--O 1.236 0.345 0 C-N-CA 123.613 0.765 . . . . 0.0 109.105 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -70.43 164.16 36.21 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 N-CA-C 107.567 -1.743 . . . . 0.0 107.567 158.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mp0 58.11 -61.45 0.03 OUTLIER 'General case' 0 N--CA 1.441 -0.912 0 C-N-CA 128.317 2.647 . . . . 0.0 112.89 -172.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 110.16 0.7 Allowed 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 121.227 1.83 . . . . 0.0 110.739 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -139.44 164.8 28.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.524 -1.216 . . . . 0.0 108.721 -176.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.16 117.11 17.07 Favored 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -177.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.5 mt -114.79 100.75 11.24 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.233 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -175.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.9 tp -72.05 86.24 1.03 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.609 1.964 . . . . 0.0 110.152 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 85.7 m -90.12 -171.66 3.2 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.458 0.703 . . . . 0.0 109.422 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.93 154.2 39.84 Favored 'Isoleucine or valine' 0 C--O 1.239 0.52 0 C-N-CA 123.181 0.592 . . . . 0.0 110.526 170.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.1 t -67.86 106.47 2.3 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.717 1.207 . . . . 0.0 107.792 162.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.19 -3.18 0.79 Allowed 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.625 1.342 . . . . 0.0 114.625 -172.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -115.65 -16.94 11.23 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 30.5 p -120.05 2.41 10.95 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 120.117 1.326 . . . . 0.0 112.688 170.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.2 t0 54.21 21.35 3.03 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.436 2.294 . . . . 0.0 112.578 -171.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.42 129.15 16.73 Favored Glycine 0 C--N 1.341 0.809 0 N-CA-C 109.956 -1.258 . . . . 0.0 109.956 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -55.32 113.1 1.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 129.254 3.022 . . . . 0.0 108.681 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.251 0.6 OUTLIER -126.55 106.49 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 122.679 1.228 . . . . 0.0 109.327 -172.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -87.5 94.26 9.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.254 1.021 . . . . 0.0 109.097 -175.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 41.6 mt -73.65 87.04 1.65 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.9 m -71.79 101.79 2.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 106.898 -1.519 . . . . 0.0 106.898 170.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 35.9 m -107.33 170.41 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 C-N-CA 125.046 1.338 . . . . 0.0 108.463 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -134.25 83.7 2.06 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 168.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.7 t -154.96 156.7 36.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.712 0.805 . . . . 0.0 109.498 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 58.6 m -72.38 166.28 22.85 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.717 0.807 . . . . 0.0 112.037 -172.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.07 -39.92 63.66 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.077 1.351 . . . . 0.0 113.708 -172.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -66.43 -42.08 88.22 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.93 0.892 . . . . 0.0 111.369 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -74.07 -41.45 61.7 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 123.749 0.82 . . . . 0.0 110.124 177.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 tt -50.18 -50.48 49.16 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.287 0.635 . . . . 0.0 110.46 167.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.0 ttt-85 -64.63 -41.95 95.82 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 124.418 1.087 . . . . 0.0 110.628 -177.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 46.5 m -63.08 -53.81 47.76 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.817 0.447 . . . . 0.0 110.66 176.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.5 pp -68.63 -30.85 69.66 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.144 0.577 . . . . 0.0 110.844 -174.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -54.13 -59.79 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.262 1.425 . . . . 0.0 108.098 164.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -59.94 -35.72 75.54 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-O 117.083 -1.437 . . . . 0.0 111.705 -168.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.35 -46.99 68.63 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 120.278 1.399 . . . . 0.0 113.903 167.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -67.1 -1.53 4.38 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 173.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -114.88 -27.91 7.24 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 126.356 1.862 . . . . 0.0 108.478 -177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.3 p -77.05 -52.31 9.54 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-O 121.257 0.551 . . . . 0.0 111.175 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -157.11 -39.93 0.07 Allowed 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 124.845 1.258 . . . . 0.0 113.007 -158.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.62 163.17 23.84 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.266 0.555 . . . . 0.0 110.198 -173.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -144.69 170.45 16.07 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 168.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -91.1 -30.18 16.88 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.064 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 22.4 t 57.48 104.72 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 127.263 2.225 . . . . 0.0 111.942 -175.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 25.9 p -56.03 150.0 31.91 Favored Pre-proline 0 CA--C 1.537 0.472 0 O-C-N 121.352 -0.842 . . . . 0.0 111.289 177.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -64.43 -25.72 63.27 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.27 1.98 . . . . 0.0 113.053 -172.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.99 -49.79 76.28 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 169.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 41.7 m -67.6 -34.06 76.25 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.828 174.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.75 -24.48 67.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 119.998 1.272 . . . . 0.0 111.814 174.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.9 m -86.08 -52.56 5.61 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.881 1.272 . . . . 0.0 111.043 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -83.6 -18.4 38.33 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.373 1.069 . . . . 0.0 112.526 -171.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 . . . . . 0 C--O 1.248 0.991 0 C-N-CA 129.752 3.221 . . . . 0.0 113.606 171.646 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.416 ' H1 ' ' CD ' ' A' ' 6' ' ' GLU . . . . . . . . 0 N--CA 1.471 0.993 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.9 t -165.55 -141.21 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 128.117 2.567 . . . . 0.0 104.933 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -62.46 -0.12 0.55 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.993 1.317 . . . . 0.0 113.394 164.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 50.1 ttm -132.16 145.36 51.31 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.285 2.234 . . . . 0.0 106.095 165.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -128.88 163.16 25.85 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 124.434 1.094 . . . . 0.0 108.857 170.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' CD ' ' H1 ' ' A' ' 1' ' ' GLY . 1.0 OUTLIER -126.37 152.42 73.94 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.874 1.67 . . . . 0.0 110.379 -166.533 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -82.08 50.46 3.46 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.909 3.073 . . . . 0.0 110.888 -170.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -148.58 -69.78 0.22 Allowed 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.522 -0.736 . . . . 0.0 109.856 -178.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -52.74 100.19 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.657 1.583 . . . . 0.0 111.177 173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -130.13 153.43 48.52 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.878 1.271 . . . . 0.0 109.546 -173.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -121.88 118.05 27.99 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.978 0.911 . . . . 0.0 108.653 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 95.5 mt -117.73 101.12 11.45 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 175.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.38 105.38 3.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 121.314 -0.867 . . . . 0.0 109.323 172.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.0 t -102.52 -179.76 4.07 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 124.406 1.082 . . . . 0.0 108.387 169.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -131.5 156.46 42.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-O 121.828 0.823 . . . . 0.0 109.292 171.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.0 t -72.31 99.71 2.47 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 162.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.2 t -58.78 -2.05 0.2 Allowed 'General case' 0 CA--C 1.549 0.926 0 N-CA-C 115.194 1.554 . . . . 0.0 115.194 -173.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -114.69 -14.3 12.03 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.049 1.34 . . . . 0.0 114.449 177.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.4 p -126.08 1.32 7.22 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.565 1.529 . . . . 0.0 113.688 169.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.2 t0 52.4 25.57 3.59 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 128.446 2.698 . . . . 0.0 113.668 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.75 137.78 26.21 Favored Glycine 0 C--N 1.34 0.759 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 177.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.472 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -70.76 124.01 23.29 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 126.528 1.931 . . . . 0.0 109.201 -176.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.3 mt -127.44 97.36 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 175.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 40.3 tt0 -79.26 95.43 5.66 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.08 80.61 2.25 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 -177.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 88.5 m -70.16 100.79 1.72 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 164.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.3 m -113.96 173.59 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 C-N-CA 125.057 1.343 . . . . 0.0 108.977 178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -124.35 104.44 8.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 162.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.41 ' OG ' ' OD2' ' A' ' 33' ' ' ASP . 5.6 t -154.43 155.5 35.08 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.013 0.824 . . . . 0.0 111.136 175.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.0 m -70.24 160.66 31.76 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.773 0.829 . . . . 0.0 111.626 -176.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.57 -42.36 67.49 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.307 1.043 . . . . 0.0 113.008 -173.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -70.53 -41.94 71.88 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.791 0.437 . . . . 0.0 111.12 -171.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.41 ' OD2' ' OG ' ' A' ' 29' ' ' SER . 16.2 t70 -64.43 -47.46 79.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.843 0.857 . . . . 0.0 109.609 171.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 tt -54.71 -40.4 69.16 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.89 -0.506 . . . . 0.0 111.504 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -70.22 -40.8 74.31 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 121.133 -0.979 . . . . 0.0 111.471 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.9 m -65.73 -47.95 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.567 0.747 . . . . 0.0 110.327 177.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.03 -34.48 59.65 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -171.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.23 -47.92 80.41 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 118.127 -0.94 . . . . 0.0 108.933 175.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.09 -33.4 75.4 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 118.2 -1.4 . . . . 0.0 112.098 -176.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.9 -42.93 89.6 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 118.497 -1.281 . . . . 0.0 110.03 179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -69.42 -27.28 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.985 0.914 . . . . 0.0 112.295 177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -73.29 -39.26 65.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.474 0.71 . . . . 0.0 110.983 171.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.7 t -71.73 -69.11 0.41 Allowed 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 125.992 1.717 . . . . 0.0 111.943 -173.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.85 -35.63 0.11 Allowed 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -158.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -71.16 165.54 23.38 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 169.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -146.49 172.75 13.07 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 125.311 1.444 . . . . 0.0 107.722 159.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -79.53 -50.35 10.86 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.911 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t 66.19 125.52 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 127.589 2.356 . . . . 0.0 111.269 -172.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 29.9 p -71.49 152.72 93.92 Favored Pre-proline 0 CA--C 1.538 0.506 0 O-C-N 120.934 -1.104 . . . . 0.0 109.961 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -64.76 -25.48 60.91 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.228 1.952 . . . . 0.0 112.94 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.5 t90 -59.94 -56.39 22.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.289 0.495 . . . . 0.0 109.733 170.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 63.8 m -63.57 -35.59 80.99 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 118.471 0.578 . . . . 0.0 111.773 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.52 -32.65 71.66 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.569 1.077 . . . . 0.0 111.545 174.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.6 m -80.56 -42.65 21.98 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.281 1.032 . . . . 0.0 111.389 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -85.55 -18.5 33.24 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.662 0.785 . . . . 0.0 112.573 -173.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 130.653 3.581 . . . . 0.0 110.779 -173.449 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.8 t -71.11 -57.13 4.81 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 118.038 0.919 . . . . 0.0 109.747 174.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 46.3 m170 -73.12 81.19 1.27 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 173.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -144.4 102.85 3.89 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.668 0.787 . . . . 0.0 109.617 -173.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -79.04 131.35 36.24 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 106.481 -1.674 . . . . 0.0 106.481 159.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -133.1 161.27 64.77 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 125.668 1.587 . . . . 0.0 106.768 170.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -64.62 168.23 13.62 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.229 1.952 . . . . 0.0 110.031 169.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 96.3 mm-40 54.66 -64.78 0.01 OUTLIER 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 128.834 2.854 . . . . 0.0 113.235 -167.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.507 HH11 ' HG3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -61.04 86.0 0.01 OUTLIER 'General case' 0 C--O 1.233 0.187 0 C-N-CA 129.075 2.95 . . . . 0.0 111.774 -172.263 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -122.21 152.45 39.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.178 1.391 . . . . 0.0 109.196 -171.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.74 101.79 6.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -172.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 73.5 mt -107.82 102.13 13.54 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 tt -74.37 103.19 4.65 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.239 -0.913 . . . . 0.0 109.933 176.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.3 t -96.17 -177.45 3.99 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.226 1.41 . . . . 0.0 108.562 168.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.16 158.74 42.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.915 0.864 . . . . 0.0 110.486 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.1 t -74.56 98.95 3.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 164.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 29.3 t -57.37 -15.4 6.39 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -172.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -95.54 -15.36 22.91 Favored 'General case' 0 C--N 1.345 0.4 0 CA-C-O 117.55 -1.214 . . . . 0.0 114.051 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -129.4 1.05 5.08 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 120.588 1.54 . . . . 0.0 114.134 175.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.8 t0 52.43 22.56 2.14 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 128.349 2.659 . . . . 0.0 113.423 -171.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -69.45 143.28 38.64 Favored Glycine 0 C--N 1.34 0.799 0 N-CA-C 109.952 -1.259 . . . . 0.0 109.952 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.92 118.58 14.95 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 127.071 2.148 . . . . 0.0 110.21 -173.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 18.0 mt -124.69 90.82 1.68 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-O 122.143 0.973 . . . . 0.0 108.78 177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -67.33 100.8 0.86 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.575 1.15 . . . . 0.0 109.71 170.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.0 mt -79.82 73.47 6.56 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 107.202 -1.407 . . . . 0.0 107.202 171.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.6 m -69.09 102.16 1.58 Allowed 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.5 m -124.08 170.92 13.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.158 0 C-N-CA 125.611 1.564 . . . . 0.0 108.908 -178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -120.91 99.49 6.54 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 t -150.89 156.24 40.81 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-O 120.896 0.379 . . . . 0.0 110.872 178.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -67.63 162.06 24.4 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.749 0.82 . . . . 0.0 111.68 -177.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -52.98 -42.85 65.95 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.522 1.129 . . . . 0.0 112.546 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -72.73 -37.05 67.88 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.13 0.572 . . . . 0.0 111.638 -171.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -68.43 -44.69 74.41 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.575 0.75 . . . . 0.0 109.767 171.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.44 -45.61 66.07 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 118.271 0.487 . . . . 0.0 110.365 170.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.86 76.0 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.617 0.767 . . . . 0.0 109.984 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.7 m -60.59 -47.01 88.07 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 124.005 0.922 . . . . 0.0 110.383 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.47 -35.71 46.27 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 -171.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.12 -34.91 79.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.388 -0.968 . . . . 0.0 108.388 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -67.35 -50.75 58.6 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 118.549 0.613 . . . . 0.0 111.174 177.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.05 -41.63 96.95 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 118.596 0.635 . . . . 0.0 111.63 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -83.76 -11.94 56.4 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.041 0.536 . . . . 0.0 111.975 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.6 mt -83.79 -34.59 24.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 119.362 0.983 . . . . 0.0 111.105 162.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -66.06 -66.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.872 1.269 . . . . 0.0 111.078 -176.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -153.53 -40.66 0.1 Allowed 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 113.348 0.869 . . . . 0.0 113.348 -158.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.36 157.78 37.02 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 -178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 66.4 p -146.6 168.7 20.63 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.01 -1.056 . . . . 0.0 109.732 173.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -103.76 31.43 4.45 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.386 0.674 . . . . 0.0 111.0 -172.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.7 p -26.26 106.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.869 2.468 . . . . 0.0 112.734 -171.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.47 148.85 63.49 Favored Pre-proline 0 CA--C 1.533 0.311 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.864 -162.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -61.99 -26.57 78.73 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.278 1.985 . . . . 0.0 112.712 -173.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -60.64 -56.36 22.18 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.815 -0.612 . . . . 0.0 110.143 170.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 70.4 m -63.65 -36.8 85.02 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 119.046 0.839 . . . . 0.0 111.629 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.95 -33.63 72.18 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.136 0.88 . . . . 0.0 111.679 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 m -80.25 -46.75 15.72 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.254 1.022 . . . . 0.0 111.258 178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.5 m-80 -82.7 -26.18 32.28 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.646 0.778 . . . . 0.0 112.2 -170.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 . . . . . 0 C--O 1.252 1.234 1 C-N-CA 133.324 4.65 . . . . 0.0 110.3 178.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.151 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 m -165.89 167.81 16.42 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 126.382 1.873 . . . . 0.0 106.725 170.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -138.55 -176.91 4.63 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.407 1.083 . . . . 0.0 108.574 175.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 42.3 ttp -150.52 173.09 14.49 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 106.006 -1.849 . . . . 0.0 106.006 163.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 57.53 69.65 0.72 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.73 1.612 . . . . 0.0 110.831 -174.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -134.25 163.78 48.72 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.144 1.778 . . . . 0.0 108.129 -176.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.8 Cg_endo -66.89 168.52 16.87 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 N-CA-C 107.694 -1.695 . . . . 0.0 107.694 158.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.26 0.0 OUTLIER 63.26 -75.79 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.549 1.139 . . . . 0.0 112.473 -173.624 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 -55.34 100.53 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.513 1.925 . . . . 0.0 112.332 -173.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -128.42 137.62 51.94 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.826 1.25 . . . . 0.0 109.504 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 99.55 8.87 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 123.557 0.743 . . . . 0.0 109.697 174.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 71.0 mt -93.51 101.81 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 107.228 -1.397 . . . . 0.0 107.228 -178.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.56 102.66 1.19 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.487 1.915 . . . . 0.0 109.338 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.8 t -110.23 -175.13 2.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.092 1.757 . . . . 0.0 109.75 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.4 m -133.86 153.89 37.23 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 124.619 1.168 . . . . 0.0 110.853 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 50.2 t -73.62 106.55 5.43 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.337 1.855 . . . . 0.0 108.116 169.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.0 t -57.48 -10.07 1.32 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.574 1.95 . . . . 0.0 114.372 -174.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -114.49 -10.91 12.52 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.888 1.275 . . . . 0.0 114.346 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 p -132.61 -0.51 3.53 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 120.7 1.591 . . . . 0.0 114.487 172.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 19.9 t0 52.38 23.96 2.71 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 128.0 2.52 . . . . 0.0 113.492 -171.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.75 139.79 16.68 Favored Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.55 -1.82 . . . . 0.0 108.55 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.38 140.78 29.7 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.124 0.488 . . . . 0.0 112.067 -162.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.3 mt -126.05 107.28 17.25 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.827 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -78.1 92.76 4.43 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 176.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 47.6 mt -71.5 82.74 0.81 Allowed 'General case' 0 C--N 1.344 0.327 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -175.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 54.5 m -75.68 95.34 3.39 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 176.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 30.0 m -111.04 168.22 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 C-N-CA 124.857 1.263 . . . . 0.0 107.969 177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -124.53 97.64 5.39 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 166.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.6 t -143.92 167.77 21.54 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 122.704 0.402 . . . . 0.0 111.175 -176.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 53.7 m -87.57 168.77 12.76 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 120.782 -1.199 . . . . 0.0 110.458 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -53.36 -48.07 68.86 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.572 1.149 . . . . 0.0 112.906 -172.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -65.61 -50.26 65.71 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.728 -0.654 . . . . 0.0 109.976 -172.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -57.89 -43.72 86.25 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 118.163 0.438 . . . . 0.0 110.28 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 tt -56.57 -38.63 72.24 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.012 0.823 . . . . 0.0 111.58 171.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.35 -44.65 64.66 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.691 1.196 . . . . 0.0 111.762 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 51.4 m -71.44 -41.73 69.09 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 124.974 1.309 . . . . 0.0 109.698 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.97 -38.1 64.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -64.36 -42.77 96.03 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 119.141 -1.023 . . . . 0.0 109.821 178.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -68.7 -35.88 77.74 Favored 'General case' 0 CA--C 1.504 -0.816 0 C-N-CA 118.003 -1.479 . . . . 0.0 111.916 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.8 mt -67.2 -40.55 86.48 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 118.667 -1.213 . . . . 0.0 110.52 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -72.19 -28.82 63.45 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.38 1.072 . . . . 0.0 111.308 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 37.5 mt -71.78 -36.59 70.38 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.846 0.748 . . . . 0.0 111.292 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.8 t -71.3 -69.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.852 1.661 . . . . 0.0 111.936 -177.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -150.98 -29.45 0.19 Allowed 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 115.04 1.496 . . . . 0.0 115.04 -158.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 166.72 16.47 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.568 0.699 . . . . 0.0 109.148 168.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.2 m -167.16 -178.37 4.1 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.439 1.896 . . . . 0.0 106.984 174.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -139.49 176.26 8.87 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.185 0.594 . . . . 0.0 110.127 -171.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.61 138.61 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 125.899 1.68 . . . . 0.0 107.693 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 27.9 p -80.06 154.11 74.94 Favored Pre-proline 0 CA--C 1.538 0.485 0 C-N-CA 122.882 0.473 . . . . 0.0 109.917 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -64.74 -26.96 60.24 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.54 2.16 . . . . 0.0 112.949 -175.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.27 -61.94 2.06 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.121 0.969 . . . . 0.0 109.503 170.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 95.6 m -64.97 -34.97 79.69 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 118.822 -0.608 . . . . 0.0 112.277 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.31 -35.48 71.92 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 119.21 0.914 . . . . 0.0 111.43 172.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -80.61 -44.06 19.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.172 0.989 . . . . 0.0 111.248 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -76.52 -22.8 53.94 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.982 0.913 . . . . 0.0 112.506 -176.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 C-N-CA 130.257 3.423 . . . . 0.0 111.597 -173.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.163 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.1 p -133.4 -90.29 0.38 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -74.53 88.3 2.13 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 167.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -137.22 146.58 45.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.896 1.278 . . . . 0.0 108.504 176.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -150.84 18.03 0.79 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.34 1.856 . . . . 0.0 113.342 -172.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -85.16 155.69 60.42 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 123.71 0.804 . . . . 0.0 110.95 -170.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -71.46 75.96 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 123.784 2.989 . . . . 0.0 110.059 173.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.257 63.0 tt0 58.49 67.14 0.97 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.067 1.747 . . . . 0.0 110.027 171.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.24 100.91 0.85 Allowed 'General case' 0 C--N 1.347 0.468 0 C-N-CA 126.014 1.725 . . . . 0.0 109.075 170.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 -99.08 170.48 8.67 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.258 0.349 . . . . 0.0 110.543 173.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -116.54 123.56 47.71 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 168.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 49.9 mt -126.41 103.97 12.19 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 C-N-CA 125.437 1.495 . . . . 0.0 107.572 -178.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 tt -66.76 109.44 2.87 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 123.924 0.89 . . . . 0.0 109.277 168.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 81.5 m -105.55 177.42 4.86 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.095 0.958 . . . . 0.0 109.5 167.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 30.1 m -135.92 155.79 36.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 CA-C-O 121.521 0.677 . . . . 0.0 112.253 177.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 47.5 t -76.73 111.52 12.33 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.584 1.153 . . . . 0.0 109.098 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 33.0 t -61.86 -13.28 22.96 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -176.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.2 mttt -80.17 -50.5 10.2 Favored 'General case' 0 C--N 1.345 0.374 0 CA-C-N 120.622 1.556 . . . . 0.0 110.252 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.9 p -116.34 0.45 12.83 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 114.715 -1.129 . . . . 0.0 112.462 -161.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.8 t0 52.07 29.35 6.25 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.339 2.256 . . . . 0.0 111.653 -173.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -64.75 133.25 37.71 Favored Glycine 0 C--N 1.34 0.778 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 tmt_? -77.22 103.31 7.08 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 128.221 2.608 . . . . 0.0 109.402 -170.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.5 mt -118.61 88.93 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-O 122.312 1.053 . . . . 0.0 108.651 -172.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -67.13 99.8 0.71 Allowed 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 125.562 1.545 . . . . 0.0 108.896 170.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -83.5 161.93 21.08 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 171.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.9 t -136.12 126.0 25.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 105.144 -2.169 . . . . 0.0 105.144 157.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 11.6 m -143.77 141.96 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 106.476 -1.675 . . . . 0.0 106.476 -172.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -108.89 113.24 25.98 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -172.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.0 t -148.85 152.67 36.88 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.9 m -53.85 142.48 23.97 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 113.536 -1.666 . . . . 0.0 107.984 163.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -49.17 -35.55 17.14 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 125.493 1.517 . . . . 0.0 113.71 -171.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -62.38 -62.44 1.76 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.204 1.402 . . . . 0.0 110.396 -176.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -71.09 -23.56 62.14 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 122.158 -0.339 . . . . 0.0 111.022 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.6 tp -65.67 -40.85 92.85 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -49.64 76.93 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.029 0.932 . . . . 0.0 109.66 171.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 23.4 m -56.75 -51.38 69.12 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.979 0.809 . . . . 0.0 111.265 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.5 pp -74.74 -33.01 62.26 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.952 0.796 . . . . 0.0 109.742 -169.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -69.38 -36.66 77.03 Favored 'General case' 0 N--CA 1.446 -0.674 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -65.76 -39.68 91.28 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 123.34 0.656 . . . . 0.0 110.971 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.4 mt -58.42 -49.73 76.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 118.161 -0.923 . . . . 0.0 110.565 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -67.02 -28.44 68.24 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -72.88 -35.52 67.16 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.794 0.725 . . . . 0.0 111.111 173.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.3 t -80.27 -71.79 0.44 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.175 1.39 . . . . 0.0 111.673 -173.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.0 m -147.38 -30.16 0.33 Allowed 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.155 0.982 . . . . 0.0 113.188 -158.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.1 tp -72.21 152.75 42.02 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.9 p -142.09 173.64 11.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.969 0.907 . . . . 0.0 108.972 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -117.42 74.9 0.95 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 -172.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 3.6 p -65.14 110.02 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -178.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 7.4 p -57.7 150.35 47.5 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 123.063 0.545 . . . . 0.0 110.968 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -64.26 -23.79 65.75 Favored 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.44 2.093 . . . . 0.0 112.615 -175.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 75.5 t-105 -57.14 -55.42 34.99 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.861 0.864 . . . . 0.0 110.626 168.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 61.9 m -68.66 -29.93 68.51 Favored 'General case' 0 N--CA 1.456 -0.132 0 C-N-CA 123.78 0.832 . . . . 0.0 112.713 177.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.78 -43.85 97.71 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.163 0.892 . . . . 0.0 110.846 169.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.4 m -72.06 -45.53 60.41 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.562 1.145 . . . . 0.0 111.246 -177.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 m-80 -72.66 -23.52 60.91 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.023 0.529 . . . . 0.0 111.02 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.117 0 C-N-CA 127.325 2.25 . . . . 0.0 110.723 176.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.341 0 N-CA-C 108.517 -1.833 . . . . 0.0 108.517 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 m -61.57 -8.63 4.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.579 1.151 . . . . 0.0 113.022 168.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -144.04 150.14 37.76 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 128.816 2.847 . . . . 0.0 107.077 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 7.3 tmm? -153.29 129.39 10.39 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 162.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -147.95 18.97 1.13 Allowed 'General case' 0 CA--C 1.528 0.11 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -84.61 149.54 54.57 Favored Pre-proline 0 C--N 1.323 -0.544 0 C-N-CA 123.102 0.561 . . . . 0.0 110.314 -173.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.23 107.37 0.8 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.309 2.672 . . . . 0.0 109.731 -177.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 43.25 68.64 0.48 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 126.15 1.78 . . . . 0.0 112.936 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.4 105.61 0.12 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.404 0.681 . . . . 0.0 109.47 162.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -131.19 132.03 44.41 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.797 1.639 . . . . 0.0 110.053 -175.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -104.62 95.84 6.18 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.856 1.262 . . . . 0.0 110.5 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.5 mt -97.13 98.14 7.13 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 -171.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' GLU . 1.2 tt -62.95 101.89 0.31 Allowed 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.476 1.11 . . . . 0.0 110.445 177.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 78.4 m -104.23 -177.59 3.41 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 122.4 0.28 . . . . 0.0 111.349 176.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 27.5 m -133.45 155.39 40.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 O-C-N 120.953 -1.092 . . . . 0.0 111.147 175.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.3 t -70.94 120.42 16.48 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.879 1.272 . . . . 0.0 108.982 169.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.0 t -57.42 -25.8 60.15 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.202 1.401 . . . . 0.0 113.402 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -90.29 -48.31 7.22 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.001 0.818 . . . . 0.0 111.176 -177.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.7 p -113.92 0.9 14.55 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.797 0.839 . . . . 0.0 112.815 -164.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.8 t70 58.77 21.11 8.59 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.787 2.035 . . . . 0.0 112.546 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.36 140.4 30.75 Favored Glycine 0 C--N 1.341 0.817 0 N-CA-C 110.309 -1.116 . . . . 0.0 110.309 -176.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -65.0 109.07 2.0 Allowed 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 127.155 2.182 . . . . 0.0 109.007 -173.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.7 mm -96.75 151.69 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 105.723 -1.955 . . . . 0.0 105.723 162.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.419 ' HA ' ' HA ' ' A' ' 13' ' ' LEU . 1.6 tt0 -134.59 115.9 14.39 Favored 'General case' 0 CA--C 1.507 -0.709 0 O-C-N 120.009 -1.682 . . . . 0.0 108.379 161.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.3 mt -79.37 85.66 5.16 Favored 'General case' 0 N--CA 1.432 -1.338 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 -176.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 26.2 m -71.56 74.75 0.79 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 119.369 0.986 . . . . 0.0 108.971 170.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.5 m -101.49 178.57 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 122.406 1.098 . . . . 0.0 109.317 -177.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.33 113.11 14.56 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 128.394 2.677 . . . . 0.0 104.434 172.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.7 m -157.77 125.18 5.16 Favored 'General case' 0 N--CA 1.437 -1.087 0 O-C-N 120.184 -1.572 . . . . 0.0 109.979 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -65.12 151.63 45.59 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.034 1.334 . . . . 0.0 110.267 -175.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -44.06 -49.12 8.9 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.316 1.447 . . . . 0.0 114.865 -170.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -76.33 -36.46 58.25 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 121.29 0.567 . . . . 0.0 110.973 -167.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -47.91 75.61 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.417 1.087 . . . . 0.0 109.599 168.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.12 -39.43 94.01 Favored 'General case' 0 C--O 1.233 0.192 0 O-C-N 122.0 -0.438 . . . . 0.0 111.297 -177.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -64.0 1.04 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 167.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 28.2 m -51.92 -44.16 63.73 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.869 0.759 . . . . 0.0 111.005 -170.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.4 pp -74.19 -36.22 64.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.431 -175.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -62.91 -34.09 76.69 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 119.416 -0.914 . . . . 0.0 110.199 175.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.27 -32.34 66.56 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 118.626 0.648 . . . . 0.0 110.697 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 89.7 mt -61.39 -49.4 77.07 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 119.083 0.856 . . . . 0.0 110.559 170.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.46 -42.15 98.33 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 118.514 0.597 . . . . 0.0 110.845 176.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 38.9 tp -59.85 -39.59 85.7 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.509 1.123 . . . . 0.0 111.401 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.8 t -72.98 -63.65 1.13 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.562 1.145 . . . . 0.0 111.501 -179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.7 m -160.19 -27.09 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 -158.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 53.4 tp -70.67 156.96 38.81 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.443 1.019 . . . . 0.0 109.026 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -161.92 172.63 15.71 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 125.845 1.658 . . . . 0.0 106.647 170.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -116.04 178.07 4.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.128 0.971 . . . . 0.0 109.214 -174.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 57.5 t -139.6 131.73 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 105.768 -1.938 . . . . 0.0 105.768 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 26.2 p -69.47 152.12 96.49 Favored Pre-proline 0 CA--C 1.538 0.486 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -62.99 -26.31 74.02 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.18 1.92 . . . . 0.0 112.65 -176.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 72.6 t90 -59.62 -59.27 5.7 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.055 0.542 . . . . 0.0 109.872 169.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.8 m -60.28 -35.17 74.93 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.865 0.757 . . . . 0.0 112.204 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.57 -40.96 96.62 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.857 0.753 . . . . 0.0 110.672 175.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.2 m -75.24 -38.21 60.7 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.214 1.006 . . . . 0.0 111.555 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -82.86 -9.22 59.42 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.305 1.042 . . . . 0.0 111.915 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.414 10.4 pt20 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 128.953 2.901 . . . . 0.0 113.222 -171.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.14 0 N-CA-C 108.747 -1.741 . . . . 0.0 108.747 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 m -62.49 -18.88 62.86 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 117.919 0.86 . . . . 0.0 112.677 173.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.2 m-70 -129.27 166.1 20.1 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 126.84 2.056 . . . . 0.0 107.176 163.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 pmm? -88.43 152.89 21.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.529 0.68 . . . . 0.0 111.639 -174.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -139.06 137.06 35.91 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 160.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -140.28 162.49 49.49 Favored Pre-proline 0 C--O 1.233 0.228 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -170.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -60.75 146.36 97.45 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 N-CA-C 108.225 -1.49 . . . . 0.0 108.225 162.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 59.7 -58.81 0.06 Allowed 'General case' 0 N--CA 1.426 -1.647 0 C-N-CA 129.107 2.963 . . . . 0.0 114.672 -175.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.1 ttm-85 -63.12 92.95 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 N-CA-C 115.281 1.585 . . . . 0.0 115.281 -166.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 27.0 m170 -118.98 150.03 40.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.174 -1.376 . . . . 0.0 109.051 -173.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mppt? -123.57 83.91 2.2 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 -173.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mt -90.24 97.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.3 tt -70.87 93.04 0.94 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 123.563 0.745 . . . . 0.0 110.016 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.4 t -81.1 171.75 14.54 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.145 0.978 . . . . 0.0 108.427 167.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.0 m -121.67 156.88 25.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.623 0.725 . . . . 0.0 109.571 164.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 49.0 t -76.88 108.22 9.77 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.218 1.407 . . . . 0.0 108.151 169.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.28 -4.66 0.88 Allowed 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.162 1.542 . . . . 0.0 115.162 -172.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -111.34 -16.87 13.27 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-N 120.354 1.434 . . . . 0.0 114.798 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 26.7 p -126.44 0.73 6.95 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.439 1.472 . . . . 0.0 113.952 172.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.1 t70 56.1 20.02 4.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.195 2.198 . . . . 0.0 112.864 -169.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.48 140.86 31.32 Favored Glycine 0 C--N 1.339 0.709 0 O-C-N 120.939 -1.101 . . . . 0.0 110.4 -174.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.6 122.55 18.73 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 126.784 2.034 . . . . 0.0 109.724 -173.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 4.6 mt -124.06 99.01 5.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 175.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -82.7 92.6 7.22 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 123.064 0.546 . . . . 0.0 109.549 -179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 23.3 mt -77.04 89.18 3.57 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 -176.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 40.6 m -67.29 97.88 0.58 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 163.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 18.0 m -134.2 127.59 51.23 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 CA-C-O 122.211 1.005 . . . . 0.0 110.204 -176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.88 92.35 7.77 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.7 p -132.68 142.99 49.34 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 127.313 2.245 . . . . 0.0 108.28 -158.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.7 m -83.53 -81.88 0.16 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 120.544 1.52 . . . . 0.0 112.393 -159.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -165.68 -61.42 0.03 OUTLIER 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 -176.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.23 -40.89 70.8 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 125.038 1.335 . . . . 0.0 109.058 178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.83 -49.05 76.44 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.002 1.321 . . . . 0.0 109.953 171.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.5 tt -58.57 -46.68 86.39 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.011 0.524 . . . . 0.0 110.185 178.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.72 -55.39 34.98 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 178.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.0 m -58.28 -47.84 82.36 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.494 -173.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 pp -65.35 -35.15 80.09 Favored 'General case' 0 C--N 1.343 0.291 0 CA-C-N 118.329 0.513 . . . . 0.0 110.759 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.51 -43.42 98.89 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 175.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -61.71 -47.45 85.2 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-N 119.102 0.864 . . . . 0.0 109.413 -178.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.73 -44.04 97.15 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.291 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -74.95 -24.49 58.48 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 123.489 0.716 . . . . 0.0 110.887 -175.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.8 mt -78.46 -36.69 45.0 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.455 0.702 . . . . 0.0 111.047 169.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.2 t -69.01 -67.43 0.47 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.798 1.239 . . . . 0.0 111.662 -173.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.46 -41.36 0.09 Allowed 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -158.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 tp -69.68 150.01 47.44 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.1 p -143.78 167.23 22.78 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 124.003 0.921 . . . . 0.0 109.038 166.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -95.3 -30.35 14.0 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -162.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 26.4 t 61.21 113.32 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 127.853 2.461 . . . . 0.0 111.916 -175.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 30.0 p -66.36 153.56 92.44 Favored Pre-proline 0 CA--C 1.54 0.582 0 O-C-N 120.949 -1.094 . . . . 0.0 110.343 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.13 -24.57 66.1 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 122.399 2.066 . . . . 0.0 112.704 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -58.76 -53.55 57.1 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.172 0.589 . . . . 0.0 110.402 170.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 39.1 m -66.82 -36.32 82.08 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 117.766 -1.112 . . . . 0.0 111.661 175.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.53 -28.98 67.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 120.1 1.318 . . . . 0.0 112.029 172.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.0 m -82.28 -43.97 16.86 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.53 1.132 . . . . 0.0 111.303 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -81.83 -40.47 22.45 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.553 0.741 . . . . 0.0 112.01 -172.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 . . . . . 0 C--O 1.256 1.397 1 C-N-CA 134.139 4.975 . . . . 0.0 112.07 172.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.052 0 N-CA-C 106.729 -2.548 . . . . 0.0 106.729 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -55.39 159.91 2.54 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 143.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -153.93 162.36 41.27 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 124.745 1.218 . . . . 0.0 108.643 178.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 56.2 ttm -157.31 140.41 15.33 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 162.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . 128.91 90.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 131.307 3.843 . . . . 0.0 108.452 -169.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 50.4 mp0 -138.89 161.19 59.57 Favored Pre-proline 0 CA--C 1.535 0.395 0 CA-C-O 119.107 -0.473 . . . . 0.0 109.89 -172.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -64.01 176.38 2.52 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 123.447 2.765 . . . . 0.0 110.704 171.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . 0.297 0.9 OUTLIER 59.5 -84.8 0.02 OUTLIER 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.978 1.711 . . . . 0.0 111.259 -169.614 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 16.6 mmt85 -51.29 103.45 0.06 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 119.936 1.244 . . . . 0.0 111.637 -175.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -125.93 138.18 53.75 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -119.63 82.49 1.89 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.772 0.829 . . . . 0.0 108.91 -173.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 28.5 mt -90.35 101.25 12.12 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.311 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 -171.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.2 tt -74.82 87.07 2.24 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.326 1.05 . . . . 0.0 110.068 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.8 t -80.02 -171.5 2.95 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.178 1.391 . . . . 0.0 108.846 159.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 m -139.67 164.93 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 O-C-N 121.153 -0.967 . . . . 0.0 111.177 174.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 42.2 t -67.87 112.91 5.18 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.319 -1.363 . . . . 0.0 107.319 166.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 8.3 t -58.51 -18.96 33.31 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.917 0.887 . . . . 0.0 113.34 -171.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -109.01 -14.75 14.49 Favored 'General case' 0 C--N 1.345 0.389 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -178.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.6 p -128.33 2.28 5.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 120.644 1.565 . . . . 0.0 114.054 177.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 57.72 20.32 6.32 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 126.234 1.814 . . . . 0.0 112.989 -174.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.45 150.85 52.09 Favored Glycine 0 CA--C 1.527 0.822 0 O-C-N 121.082 -1.011 . . . . 0.0 110.633 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.407 ' CG ' HH11 ' A' ' 22' ' ' ARG . 0.0 OUTLIER -66.51 112.01 3.88 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.705 2.002 . . . . 0.0 108.833 -172.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 13.0 mm -121.64 85.61 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 123.369 1.557 . . . . 0.0 108.05 173.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.82 121.24 15.04 Favored 'General case' 0 N--CA 1.429 -1.521 0 CA-C-N 113.455 -1.702 . . . . 0.0 107.443 159.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 12.1 mt -86.39 75.96 9.72 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 161.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.3 m -73.77 94.88 2.31 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 165.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 27.5 m -118.67 175.55 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.829 1.651 . . . . 0.0 108.45 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -120.47 119.87 34.25 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.314 -1.736 . . . . 0.0 106.314 162.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 29.6 t -143.25 169.01 18.43 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.639 1.176 . . . . 0.0 109.491 -168.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.8 m -95.94 175.46 6.48 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 159.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.14 79.64 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.405 0.682 . . . . 0.0 111.958 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -68.09 -40.05 82.71 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 124.198 0.999 . . . . 0.0 110.764 -178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -63.51 -47.91 79.74 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.378 1.471 . . . . 0.0 109.404 173.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.6 tt -56.83 -46.62 81.57 Favored 'General case' 0 C--N 1.342 0.256 0 C-N-CA 123.675 0.79 . . . . 0.0 109.962 175.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 67.0 ttt180 -59.88 -52.25 66.22 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 44.7 m -56.91 -52.23 65.98 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 124.241 1.016 . . . . 0.0 111.117 -177.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.93 -31.49 72.69 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -63.16 -44.5 95.29 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-O 118.323 -0.846 . . . . 0.0 109.354 172.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -59.32 -46.1 89.51 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-N 119.523 1.056 . . . . 0.0 110.311 -178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -46.87 80.14 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.291 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -65.73 -26.59 67.81 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.795 0.685 . . . . 0.0 112.563 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 57.4 tp -75.67 -33.87 60.43 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.317 1.847 . . . . 0.0 111.168 172.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -75.68 -67.37 0.67 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.112 0.965 . . . . 0.0 111.23 -172.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.6 p -157.76 -36.38 0.07 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.851 1.261 . . . . 0.0 112.515 -158.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.21 154.01 40.96 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 16.8 p -144.3 168.37 20.23 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 124.536 1.134 . . . . 0.0 108.189 168.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -91.5 -57.02 2.9 Favored 'General case' 0 C--O 1.226 -0.156 0 O-C-N 123.328 0.393 . . . . 0.0 110.665 -176.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 41.3 t 67.85 134.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 127.714 2.406 . . . . 0.0 110.338 -174.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 10.8 p -71.44 149.55 93.76 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.686 -1.259 . . . . 0.0 109.164 174.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.12 -25.48 65.67 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.316 2.01 . . . . 0.0 113.087 -176.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -66.61 -37.92 85.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 119.102 -0.475 . . . . 0.0 110.936 172.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.3 m -76.29 -27.35 56.6 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 117.974 -1.012 . . . . 0.0 112.024 170.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.85 -33.66 74.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.957 1.708 . . . . 0.0 110.718 169.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.2 m -76.63 -62.5 1.61 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.139 0.976 . . . . 0.0 111.219 175.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -83.9 -23.71 31.1 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -167.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 . . . . . 0 C--O 1.246 0.877 0 C-N-CA 128.402 2.681 . . . . 0.0 113.449 177.822 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.897 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 t 44.86 49.21 9.13 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.865 2.466 . . . . 0.0 112.304 -173.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.7 t-80 -132.49 -79.04 0.5 Allowed 'General case' 0 C--O 1.232 0.153 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 168.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.436 ' HG2' ' H ' ' A' ' 5' ' ' ALA . 30.8 ttm -148.15 178.88 8.18 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.564 2.746 . . . . 0.0 105.657 174.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.436 ' H ' ' HG2' ' A' ' 4' ' ' MET . . . 55.43 68.55 0.85 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.567 1.547 . . . . 0.0 110.761 -173.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -138.15 156.36 73.9 Favored Pre-proline 0 C--O 1.238 0.452 0 C-N-CA 126.022 1.729 . . . . 0.0 107.722 -177.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.55 74.87 3.64 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.572 2.848 . . . . 0.0 110.643 -177.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 56.05 62.61 2.3 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.385 1.874 . . . . 0.0 111.301 178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.59 108.04 0.21 Allowed 'General case' 0 C--N 1.338 0.082 0 C-N-CA 126.539 1.936 . . . . 0.0 110.804 166.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -125.97 166.37 17.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 125.097 1.359 . . . . 0.0 110.303 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.46 89.27 3.01 Favored 'General case' 0 C--N 1.338 0.104 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.7 mt -78.98 94.65 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.201 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 174.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.8 tt -68.24 103.31 1.55 Allowed 'General case' 0 N--CA 1.447 -0.605 0 O-C-N 121.221 -0.925 . . . . 0.0 109.255 170.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t -104.71 179.01 4.4 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.897 0.879 . . . . 0.0 108.865 170.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.1 m -134.25 153.94 36.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-O 121.747 0.784 . . . . 0.0 111.027 -177.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 21' ' ' GLY . 42.6 t -73.88 115.13 12.96 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 125.359 1.464 . . . . 0.0 109.818 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 9.5 t -59.7 -13.34 9.52 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.551 1.54 . . . . 0.0 113.905 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -115.7 -11.24 11.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.944 1.461 . . . . 0.0 114.944 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.7 p -136.09 1.86 2.76 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 120.943 1.701 . . . . 0.0 114.855 174.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 21.4 t0 55.55 20.79 4.0 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 127.477 2.311 . . . . 0.0 113.5 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.428 ' H ' ' HB3' ' A' ' 16' ' ' CYS . . . -71.92 140.88 30.8 Favored Glycine 0 C--N 1.34 0.757 0 O-C-N 120.823 -1.173 . . . . 0.0 110.265 -177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.474 ' HE ' ' HB2' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -69.43 123.46 21.29 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.673 1.989 . . . . 0.0 109.391 -175.466 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.5 mp -119.61 106.49 19.25 Favored 'Isoleucine or valine' 0 C--N 1.339 0.117 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 164.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.474 ' HB2' ' HE ' ' A' ' 22' ' ' ARG . 41.2 tt0 -81.38 90.42 6.17 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 174.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.5 mt -70.2 86.42 0.57 Allowed 'General case' 0 C--O 1.232 0.182 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -178.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 34.4 m -70.09 101.37 1.81 Allowed 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 168.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.2 m -136.61 139.58 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.091 0.956 . . . . 0.0 108.617 -177.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.5 mp0 -95.58 91.27 6.06 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 105.23 -2.137 . . . . 0.0 105.23 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.1 p -132.65 120.26 21.51 Favored 'General case' 0 N--CA 1.443 -0.812 0 C-N-CA 124.57 1.148 . . . . 0.0 109.872 -166.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.1 m -57.81 148.13 26.13 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.72 1.263 . . . . 0.0 109.452 177.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -50.9 -40.59 57.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.869 0.867 . . . . 0.0 113.042 -173.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -65.9 -45.32 82.41 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.342 1.057 . . . . 0.0 111.764 178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -59.75 -54.85 41.46 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.2 tt -52.43 -48.63 65.64 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 124.039 0.936 . . . . 0.0 110.584 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -57.05 -48.09 79.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 123.679 0.791 . . . . 0.0 109.695 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -56.45 -50.12 72.62 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 123.604 0.762 . . . . 0.0 110.43 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.46 -43.7 71.9 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -67.5 -36.29 80.79 Favored 'General case' 0 N--CA 1.422 -1.833 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.318 -169.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -62.04 -46.51 88.82 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 123.748 0.819 . . . . 0.0 109.634 173.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.3 mt -62.03 -52.43 63.99 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 118.416 -0.802 . . . . 0.0 110.59 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -64.17 -29.23 70.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.1 tt -70.67 -41.43 72.06 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.087 0.955 . . . . 0.0 111.251 172.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 t -70.15 -68.04 0.45 Allowed 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 125.727 1.611 . . . . 0.0 111.422 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -155.08 -34.19 0.09 Allowed 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -158.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 20.1 tp -71.0 165.92 22.44 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 121.86 0.838 . . . . 0.0 109.154 175.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.5 m -159.38 -175.04 4.98 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 170.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -118.62 169.37 9.87 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 124.16 0.984 . . . . 0.0 108.712 -176.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 5.9 p -144.97 132.33 16.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 106.566 -1.642 . . . . 0.0 106.566 172.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 24.4 p -70.41 154.45 94.45 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.911 -0.566 . . . . 0.0 109.933 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -63.7 -31.59 69.19 Favored 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 122.243 1.962 . . . . 0.0 112.719 -174.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 85.6 t90 -56.55 -49.92 73.38 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.745 0.818 . . . . 0.0 110.397 169.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.8 m -68.86 -31.19 69.97 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.167 175.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.14 71.04 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 120.093 1.315 . . . . 0.0 111.513 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.99 -16.62 18.65 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 23.3 m-80 -108.84 -31.25 7.76 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.562 1.073 . . . . 0.0 111.964 176.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . 0.27 69.1 mt-30 . . . . . 0 C--O 1.255 1.361 0 C-N-CA 129.787 3.235 . . . . 0.0 115.883 176.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_