data_2vrd_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 2vrd _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 3' ' ' LYS . . . . . . . . . . . . . 22.4 mttt . . . . . 0 N--CA 1.504 2.267 0 CA-C-O 121.145 0.497 . . . . 0.0 110.926 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -112.71 157.71 20.95 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.99 -1.069 . . . . 0.0 109.979 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -136.36 140.22 43.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.187 -0.946 . . . . 0.0 110.471 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.7 t -110.45 97.41 6.86 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.134 -0.979 . . . . 0.0 110.136 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -52.36 -35.87 52.32 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.036 -1.04 . . . . 0.0 110.534 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 93.2 m-85 -62.67 -33.06 74.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.135 -0.978 . . . . 0.0 110.243 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.3 m -100.11 -3.05 32.65 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.028 -1.045 . . . . 0.0 112.282 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 53.24 38.3 27.3 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.409 -1.432 . . . . 0.0 110.75 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 t -129.32 173.53 10.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.158 -0.964 . . . . 0.0 110.03 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -123.69 108.68 12.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 110.099 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mp -69.57 157.08 37.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.147 -0.971 . . . . 0.0 109.905 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.401 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -101.95 -31.15 10.82 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.21 -0.931 . . . . 0.0 111.875 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.401 ' CD2' HG21 ' A' ' 14' ' ' THR . 48.2 m-70 -112.03 98.47 7.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.744 -1.223 . . . . 0.0 110.33 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.36 71.06 9.42 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.232 -0.918 . . . . 0.0 110.429 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -110.33 179.87 0.76 Allowed Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.085 -1.009 . . . . 0.0 109.908 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.81 -30.13 11.76 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.303 1.159 . . . . 0.0 111.421 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.4 t -89.84 -40.88 12.15 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.929 -1.107 . . . . 0.0 110.088 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.67 -50.52 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.123 -0.986 . . . . 0.0 109.759 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -57.56 -51.58 68.88 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.098 -1.001 . . . . 0.0 109.628 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -62.1 -41.09 97.86 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.828 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.4 m -54.83 -42.97 72.56 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.137 -0.977 . . . . 0.0 108.552 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.37 -36.12 81.27 Favored 'General case' 0 N--CA 1.503 2.215 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.161 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -99.4 44.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.121 -0.987 . . . . 0.0 110.573 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.55 38.19 3.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.106 -0.996 . . . . 0.0 110.137 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.1 127.28 3.06 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -54.41 -28.29 42.72 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.209 -1.171 . . . . 0.0 110.338 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -60.66 -32.18 71.38 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.994 -1.066 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -49.8 -37.14 28.88 Favored 'General case' 0 N--CA 1.518 2.939 0 O-C-N 120.884 -1.135 . . . . 0.0 110.914 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -61.83 -55.62 27.94 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.11 -0.994 . . . . 0.0 109.23 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.63 -38.83 82.43 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.189 -0.944 . . . . 0.0 109.193 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -55.95 -37.27 68.77 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.153 -0.967 . . . . 0.0 110.13 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 75.8 t -56.15 -35.26 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 121.021 -1.049 . . . . 0.0 110.186 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 35.7 tttt -53.38 -41.51 65.98 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.875 -1.14 . . . . 0.0 109.93 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.4 -29.32 65.96 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -70.92 -52.26 21.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.876 -1.14 . . . . 0.0 110.321 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.9 p90 -99.61 33.79 2.41 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.013 -1.055 . . . . 0.0 111.406 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -79.86 -38.15 33.4 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.754 -1.216 . . . . 0.0 110.171 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -116.5 26.36 9.94 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.244 -0.91 . . . . 0.0 111.372 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.0 t90 -56.09 -43.14 77.75 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.873 -1.142 . . . . 0.0 110.218 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.469 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 19.8 ptp -152.75 38.59 0.53 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.156 -0.965 . . . . 0.0 110.74 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 51.31 39.74 24.73 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.02 -1.05 . . . . 0.0 110.965 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -144.43 -165.63 2.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.155 -0.966 . . . . 0.0 110.304 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -117.29 123.98 47.88 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.221 -0.924 . . . . 0.0 110.253 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.404 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -129.91 79.04 1.88 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.413 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 4.1 tt0 -109.34 36.33 2.96 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.11 -0.994 . . . . 0.0 110.463 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.4 t -114.65 -54.98 2.53 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.124 -0.985 . . . . 0.0 109.793 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -22.46 60.74 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 111.479 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 HG13 ' CE2' ' A' ' 38' ' ' TYR . 42.3 mm -65.15 -51.38 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 O-C-N 120.648 -1.282 . . . . 0.0 109.367 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -39.27 72.17 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.104 -0.997 . . . . 0.0 110.406 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -62.98 -36.01 82.09 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.211 -0.93 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.0 m . . . . . 0 N--CA 1.505 2.304 0 O-C-N 121.069 -1.019 . . . . 0.0 110.16 179.854 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.505 2.287 0 CA-C-O 121.066 0.46 . . . . 0.0 110.754 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 52.7 t80 -104.64 156.43 17.98 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.998 -1.064 . . . . 0.0 110.038 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -127.46 137.41 52.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.149 -0.969 . . . . 0.0 110.412 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.35 97.98 6.65 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -54.77 -36.36 64.79 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.056 -1.027 . . . . 0.0 110.284 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.42 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.3 m-85 -60.26 -32.84 71.55 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.029 -1.045 . . . . 0.0 110.111 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.9 m -95.79 -1.41 49.75 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.037 -1.04 . . . . 0.0 112.033 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t0 52.39 39.02 26.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.428 -1.42 . . . . 0.0 110.574 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -146.4 171.86 14.38 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.203 -0.936 . . . . 0.0 110.098 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -120.44 122.61 41.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.15 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.34 170.72 12.55 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.174 -0.954 . . . . 0.0 109.826 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 t -100.22 -29.89 12.21 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.296 -0.877 . . . . 0.0 111.767 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 m-70 -113.25 147.66 37.1 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.696 -1.252 . . . . 0.0 110.404 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -123.62 94.58 4.28 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.28 -0.888 . . . . 0.0 109.9 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.418 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.12 177.67 1.72 Allowed Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.258 -0.901 . . . . 0.0 110.212 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.418 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.4 Cg_endo -70.97 -31.94 14.34 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 O-C-N 123.435 1.229 . . . . 0.0 110.933 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -89.28 -39.62 13.36 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.014 -1.054 . . . . 0.0 110.073 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.43 -46.54 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.067 -1.021 . . . . 0.0 109.692 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 15.3 mtp180 -60.55 -49.46 77.47 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.084 -1.01 . . . . 0.0 109.574 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttt -62.28 -41.15 98.24 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.891 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.2 m -54.58 -42.28 70.87 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.087 -1.008 . . . . 0.0 108.442 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.35 -35.26 79.79 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.394 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -100.18 43.54 1.05 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.123 -0.985 . . . . 0.0 110.56 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -114.93 40.39 2.64 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.09 -1.006 . . . . 0.0 109.824 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -131.38 157.04 22.13 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 ttm-85 -85.51 -10.13 56.45 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.254 -1.145 . . . . 0.0 111.026 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -90.53 -26.01 19.95 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.691 -1.255 . . . . 0.0 111.11 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -49.76 -38.88 35.74 Favored 'General case' 0 N--CA 1.517 2.916 0 O-C-N 120.814 -1.179 . . . . 0.0 110.574 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -64.58 -53.72 43.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.816 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.09 -39.97 91.94 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.196 -0.94 . . . . 0.0 108.999 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -56.53 -37.88 71.08 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.205 -0.935 . . . . 0.0 110.031 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.42 HG12 ' CE1' ' A' ' 8' ' ' TYR . 93.5 t -57.66 -33.73 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.125 -0.984 . . . . 0.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.0 tttt -52.24 -42.26 63.45 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.87 -1.144 . . . . 0.0 109.849 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.08 -29.53 63.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.336 -0.852 . . . . 0.0 110.375 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -69.38 -52.02 31.08 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.942 -1.099 . . . . 0.0 110.319 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.7 p90 -99.72 35.0 2.1 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.077 -1.014 . . . . 0.0 111.382 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -88.11 -38.34 15.47 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.807 -1.183 . . . . 0.0 109.884 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -112.91 31.58 6.3 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 110.765 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -92.85 -41.7 9.93 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.142 -0.974 . . . . 0.0 110.026 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.445 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -154.95 -65.76 0.13 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.14 -0.975 . . . . 0.0 110.599 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -126.57 -171.55 2.43 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.965 . . . . 0.0 110.005 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.25 38.81 3.44 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.1 -1.0 . . . . 0.0 110.342 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -152.96 75.23 1.08 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.237 -0.914 . . . . 0.0 110.484 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.419 ' HB1' ' CD2' ' A' ' 38' ' ' TYR . . . -136.55 75.43 1.54 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.199 -0.938 . . . . 0.0 110.224 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -111.36 35.86 3.44 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.095 -1.003 . . . . 0.0 110.435 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.54 -55.47 2.5 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.201 -0.937 . . . . 0.0 109.24 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.98 64.51 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.307 -0.871 . . . . 0.0 111.189 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.6 -40.27 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.62 -1.3 . . . . 0.0 109.618 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -72.76 -39.83 66.5 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.128 -0.983 . . . . 0.0 110.013 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -57.02 -36.22 70.18 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.179 -0.951 . . . . 0.0 110.63 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 90.0 m . . . . . 0 N--CA 1.504 2.25 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.921 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mttp . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CE1' ' NH2' ' A' ' 21' ' ' ARG . 43.5 t80 -114.36 156.36 24.58 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.244 -0.91 . . . . 0.0 110.01 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -135.43 136.79 41.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.399 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -112.27 95.39 5.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.209 -0.932 . . . . 0.0 110.222 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.94 -36.16 59.55 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 121.026 -1.046 . . . . 0.0 110.383 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CE1' HG12 ' A' ' 34' ' ' VAL . 90.1 m-85 -60.45 -32.18 71.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.149 -0.97 . . . . 0.0 110.067 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -97.66 -1.54 43.41 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.064 -1.023 . . . . 0.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.92 38.51 27.16 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.377 -1.452 . . . . 0.0 110.567 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -139.5 173.07 11.92 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.162 -0.961 . . . . 0.0 109.964 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.96 119.53 30.69 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.279 -0.888 . . . . 0.0 110.254 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 mp -78.1 163.98 25.39 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.11 -0.994 . . . . 0.0 109.383 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 t -101.05 -21.79 14.91 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.132 -0.98 . . . . 0.0 112.166 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -120.53 139.6 52.67 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.628 -1.295 . . . . 0.0 110.145 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -120.6 93.19 3.96 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.253 -0.904 . . . . 0.0 109.78 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.51 178.39 1.65 Allowed Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.321 -0.862 . . . . 0.0 109.993 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.62 -26.82 23.09 Favored 'Trans proline' 0 C--N 1.315 -1.196 0 O-C-N 123.351 1.185 . . . . 0.0 111.308 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.08 -40.71 9.92 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.893 -1.129 . . . . 0.0 110.16 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 83.9 t -60.12 -48.39 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.031 -1.043 . . . . 0.0 109.884 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.421 ' NH2' ' CE1' ' A' ' 4' ' ' PHE . 19.6 mtp180 -56.99 -51.69 68.22 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.132 -0.98 . . . . 0.0 109.86 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -60.18 -40.55 90.38 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.179 -0.95 . . . . 0.0 109.048 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 42.1 m -54.69 -42.92 72.03 Favored 'General case' 0 N--CA 1.513 2.675 0 O-C-N 121.035 -1.041 . . . . 0.0 108.369 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -63.73 -38.61 91.76 Favored 'General case' 0 N--CA 1.502 2.175 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.004 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.02 51.93 1.27 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.298 -0.876 . . . . 0.0 110.488 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 37.69 3.82 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.06 -1.025 . . . . 0.0 110.327 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.68 122.8 1.75 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -50.87 -30.26 14.09 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.118 -1.225 . . . . 0.0 110.847 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -33.16 69.6 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.095 -1.003 . . . . 0.0 110.503 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -50.06 -38.28 37.37 Favored 'General case' 0 N--CA 1.517 2.887 0 O-C-N 121.016 -1.053 . . . . 0.0 110.694 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -62.55 -53.17 58.71 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.161 -0.962 . . . . 0.0 108.972 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -60.61 -39.66 89.01 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.221 -0.924 . . . . 0.0 109.0 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.13 -38.43 68.21 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.207 -0.933 . . . . 0.0 110.099 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG12 ' CE1' ' A' ' 8' ' ' TYR . 74.6 t -59.27 -37.9 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 109.894 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 1.5 tppp? -56.99 -41.79 79.06 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.973 -1.08 . . . . 0.0 109.509 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.27 -29.81 67.84 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.251 -0.905 . . . . 0.0 110.101 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -68.54 -52.53 30.97 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.957 -1.089 . . . . 0.0 110.28 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.1 p90 -98.53 24.82 6.97 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.085 -1.01 . . . . 0.0 111.82 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -65.34 -41.23 94.11 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 120.626 -1.296 . . . . 0.0 109.745 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 mtmt -122.63 26.3 8.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.35 -0.844 . . . . 0.0 111.164 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.0 t90 -64.4 -40.6 96.11 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.888 -1.133 . . . . 0.0 110.219 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.449 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 mtm -156.29 -56.53 0.09 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.138 -0.976 . . . . 0.0 110.845 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -126.08 -171.84 2.48 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.138 -0.976 . . . . 0.0 110.532 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -34.19 11.25 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.158 -0.964 . . . . 0.0 111.015 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -93.32 96.17 9.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.927 -1.108 . . . . 0.0 110.189 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -141.48 71.21 1.35 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -121.18 34.14 5.31 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.21 -0.931 . . . . 0.0 110.635 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -106.76 -51.48 2.93 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.125 -0.984 . . . . 0.0 109.558 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -21.14 62.73 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.215 -0.928 . . . . 0.0 111.499 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.469 HD11 HG22 ' A' ' 50' ' ' ILE . 49.9 mm -77.85 -56.3 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 O-C-N 120.665 -1.272 . . . . 0.0 109.77 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.34 -36.71 71.51 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -73.01 -34.04 66.13 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.647 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.6 m . . . . . 0 N--CA 1.505 2.317 0 O-C-N 120.939 -1.101 . . . . 0.0 110.163 179.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 35.0 mmtm . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.451 ' CD2' ' NH1' ' A' ' 21' ' ' ARG . 76.9 t80 -116.26 161.95 18.23 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -132.72 136.15 46.21 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.237 -0.915 . . . . 0.0 110.212 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.39 97.24 6.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.199 -0.938 . . . . 0.0 109.905 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -51.39 -35.57 39.47 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.121 -0.987 . . . . 0.0 110.554 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.428 ' CD1' HG12 ' A' ' 34' ' ' VAL . 92.3 m-85 -62.7 -30.8 71.68 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.145 -0.972 . . . . 0.0 110.249 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.3 m -100.02 -8.98 23.2 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.952 -1.093 . . . . 0.0 112.118 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.95 42.44 31.06 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.391 -1.443 . . . . 0.0 110.087 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -145.35 172.43 13.17 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.289 -0.882 . . . . 0.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 3.5 t80 -118.29 129.49 55.49 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.255 -0.903 . . . . 0.0 110.305 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 mp -85.9 170.2 12.58 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.173 -0.955 . . . . 0.0 109.861 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.0 t -97.26 -21.96 16.96 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.198 -0.939 . . . . 0.0 111.696 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -122.16 147.29 46.34 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.619 -1.301 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -127.08 93.54 3.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.208 -0.933 . . . . 0.0 109.81 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.19 179.1 1.25 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.284 -0.885 . . . . 0.0 110.17 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.03 -32.09 13.9 Favored 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.326 1.171 . . . . 0.0 110.811 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.7 OUTLIER -85.54 -39.72 17.1 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.975 -1.078 . . . . 0.0 109.956 179.373 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.5 t -64.9 -47.12 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 O-C-N 121.11 -0.993 . . . . 0.0 109.678 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.451 ' NH1' ' CD2' ' A' ' 4' ' ' PHE . 11.7 mtp180 -57.61 -51.96 67.39 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.072 -1.017 . . . . 0.0 109.588 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -60.77 -40.36 92.23 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.184 -0.948 . . . . 0.0 108.82 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.5 m -55.18 -43.38 74.3 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.141 -0.975 . . . . 0.0 108.546 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -61.69 -37.29 83.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.426 -0.796 . . . . 0.0 109.061 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.25 50.06 1.07 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.187 -0.946 . . . . 0.0 110.369 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.71 37.63 3.88 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.051 -1.031 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.68 128.44 3.35 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.2 tpp85 -54.47 -28.52 45.15 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.141 -1.211 . . . . 0.0 110.413 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -59.5 -35.77 74.79 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.977 -1.077 . . . . 0.0 110.355 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.78 -46.09 64.03 Favored 'General case' 0 N--CA 1.514 2.725 0 O-C-N 120.931 -1.106 . . . . 0.0 110.489 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -54.57 45.59 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.086 -1.009 . . . . 0.0 109.427 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -60.09 -39.47 86.23 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.186 -0.946 . . . . 0.0 109.073 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -56.85 -38.67 73.0 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.948 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.428 HG12 ' CD1' ' A' ' 8' ' ' TYR . 65.9 t -59.06 -38.21 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.554 0 O-C-N 121.139 -0.976 . . . . 0.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 29.3 ttmt -54.97 -40.58 70.16 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.949 -1.095 . . . . 0.0 109.832 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -58.11 -30.16 66.06 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.304 -0.873 . . . . 0.0 110.229 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.24 -53.51 24.15 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.931 -1.106 . . . . 0.0 110.177 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -98.14 22.79 9.01 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.137 -0.977 . . . . 0.0 111.702 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.78 -38.4 90.47 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.593 -1.317 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -113.89 33.28 5.3 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.157 -0.964 . . . . 0.0 110.742 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.5 t90 -92.16 -40.51 10.97 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.19 -0.944 . . . . 0.0 110.151 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.434 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 ttm -151.78 -62.98 0.17 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.17 -0.956 . . . . 0.0 110.664 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -122.24 -172.9 2.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.0 110.524 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -98.32 -37.35 9.68 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.225 -0.922 . . . . 0.0 110.783 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -105.47 92.81 4.35 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.092 -1.005 . . . . 0.0 110.219 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.52 74.85 1.59 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -0.919 . . . . 0.0 110.13 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.16 35.54 3.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.099 -1.001 . . . . 0.0 110.492 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.0 t -110.5 -54.64 2.56 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.096 -1.002 . . . . 0.0 109.395 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -20.7 64.34 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.25 -0.906 . . . . 0.0 111.393 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.6 mm -72.33 -44.91 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 120.681 -1.262 . . . . 0.0 109.788 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -62.79 -48.59 78.48 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.168 -0.957 . . . . 0.0 109.887 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -56.52 -33.48 66.08 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.143 -0.973 . . . . 0.0 110.632 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.3 m . . . . . 0 N--CA 1.503 2.204 0 O-C-N 120.945 -1.097 . . . . 0.0 110.351 179.869 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.4 mttt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 5' ' ' TYR . 58.8 t80 -110.4 161.65 15.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.103 -0.998 . . . . 0.0 110.522 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD2' ' A' ' 4' ' ' PHE . 34.9 t80 -133.7 134.06 42.62 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.252 -0.905 . . . . 0.0 110.115 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.9 t -113.53 96.39 5.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -0.975 . . . . 0.0 110.177 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -53.71 -36.34 62.13 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.388 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.432 ' CE2' HG12 ' A' ' 34' ' ' VAL . 83.6 m-85 -60.74 -32.4 71.67 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.091 -1.006 . . . . 0.0 110.156 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.5 m -96.99 -5.94 36.62 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.076 -1.015 . . . . 0.0 112.116 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 54.75 39.98 31.67 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.349 -1.47 . . . . 0.0 110.23 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -143.42 172.24 13.05 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.236 -0.915 . . . . 0.0 109.918 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -117.34 138.82 51.53 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.271 -0.893 . . . . 0.0 110.469 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -97.68 168.42 10.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.222 -0.924 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.416 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -99.38 -29.07 12.98 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.217 -0.927 . . . . 0.0 111.73 -179.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.416 ' CD2' HG21 ' A' ' 14' ' ' THR . 54.6 m-70 -112.06 148.42 33.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.774 -1.204 . . . . 0.0 110.431 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -126.92 93.93 3.89 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.331 -0.856 . . . . 0.0 109.761 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.422 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -150.82 178.52 1.49 Allowed Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.272 -0.893 . . . . 0.0 110.305 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.07 -33.3 11.94 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.354 1.186 . . . . 0.0 110.735 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 23' ' ' THR . 2.7 t -83.16 -38.59 22.15 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.011 -1.056 . . . . 0.0 110.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.2 t -64.1 -47.38 90.43 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -57.97 -50.07 74.62 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.097 -1.002 . . . . 0.0 109.53 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.12 -40.99 97.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.214 -0.929 . . . . 0.0 108.655 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' SER . 96.5 m -55.48 -43.84 75.92 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.159 -0.963 . . . . 0.0 108.487 178.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -62.59 -39.49 93.88 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.353 -0.842 . . . . 0.0 108.863 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.5 t -92.42 56.0 2.65 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.278 -0.889 . . . . 0.0 110.335 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -118.5 37.42 4.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.127 -0.983 . . . . 0.0 110.414 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.15 128.27 3.23 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -54.54 -28.18 43.7 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.153 -1.204 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.941 -1.1 . . . . 0.0 110.522 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -51.47 -40.66 59.92 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.951 -1.093 . . . . 0.0 110.523 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.2 tttt -62.75 -55.61 25.03 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.196 -0.94 . . . . 0.0 109.064 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -59.34 -38.85 81.38 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.2 -0.938 . . . . 0.0 109.189 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.62 -38.23 71.81 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.432 HG12 ' CE2' ' A' ' 8' ' ' TYR . 79.5 t -64.46 -39.57 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 O-C-N 121.134 -0.978 . . . . 0.0 109.641 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.3 ttpt -58.38 -42.79 87.86 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.069 -1.019 . . . . 0.0 109.348 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.02 -30.2 67.84 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.529 -0.869 . . . . 0.0 110.283 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -70.41 -51.82 26.81 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.901 -1.125 . . . . 0.0 110.322 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.438 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 40.3 p90 -100.03 34.54 2.28 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.13 -0.981 . . . . 0.0 111.295 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -78.3 -39.63 39.2 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.814 -1.179 . . . . 0.0 110.0 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tttm -117.82 22.69 12.15 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.243 -0.91 . . . . 0.0 111.53 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 13.1 t90 -57.61 -55.29 36.75 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.796 -1.19 . . . . 0.0 110.151 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.457 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 13.2 mtt -149.1 -63.1 0.23 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -122.79 -171.95 2.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.161 -0.962 . . . . 0.0 110.06 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -110.76 39.72 2.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.227 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -145.55 75.02 1.41 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.917 . . . . 0.0 110.174 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.46 71.73 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.239 -0.913 . . . . 0.0 110.343 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.76 34.71 5.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.254 -0.904 . . . . 0.0 110.574 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 7.2 p -108.12 -52.57 2.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.056 -1.027 . . . . 0.0 109.418 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.408 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -60.92 -21.12 63.08 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.195 -0.941 . . . . 0.0 111.418 179.376 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.422 HG21 HD11 ' A' ' 50' ' ' ILE . 49.5 mm -76.12 -52.22 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.659 -1.276 . . . . 0.0 109.597 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -58.45 -39.39 79.72 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.2 -0.937 . . . . 0.0 110.195 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -55.88 -36.34 67.49 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.076 -1.015 . . . . 0.0 110.625 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.504 2.272 0 O-C-N 121.08 -1.013 . . . . 0.0 110.172 179.871 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.5 mttt . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -115.65 162.06 17.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.112 -0.993 . . . . 0.0 110.089 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -136.18 132.83 36.47 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.202 -0.936 . . . . 0.0 110.187 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.1 t -112.44 94.1 4.76 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.085 -1.009 . . . . 0.0 110.051 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -52.06 -35.98 49.13 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.074 -1.016 . . . . 0.0 110.518 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CE1' HG12 ' A' ' 34' ' ' VAL . 83.5 m-85 -61.07 -32.8 72.44 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.18 -0.95 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.5 m -97.47 -4.08 38.76 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.001 -1.062 . . . . 0.0 112.261 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 53.54 38.99 29.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.446 -1.409 . . . . 0.0 110.479 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -140.68 170.33 15.98 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.904 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.11 137.08 53.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -95.12 163.98 13.06 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.7 t -100.41 -31.65 11.2 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.041 -1.037 . . . . 0.0 111.724 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.5 m-70 -114.61 132.96 56.18 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.718 -1.239 . . . . 0.0 110.194 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.84 95.94 5.69 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.257 -0.902 . . . . 0.0 109.809 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -141.58 179.37 1.24 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.2 -0.937 . . . . 0.0 109.966 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.17 -28.04 19.25 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.314 1.165 . . . . 0.0 111.176 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.401 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -90.88 -41.94 10.89 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.901 -1.125 . . . . 0.0 109.974 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.1 t -60.92 -50.96 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.524 0 O-C-N 121.178 -0.951 . . . . 0.0 109.66 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -57.09 -51.11 70.61 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.125 -0.984 . . . . 0.0 109.607 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -61.33 -40.57 94.7 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.797 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 19' ' ' SER . 92.5 m -54.77 -43.56 72.87 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.121 -0.987 . . . . 0.0 108.443 178.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -63.47 -39.72 95.21 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.08 52.12 1.27 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -117.83 37.63 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.154 -0.966 . . . . 0.0 110.347 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.67 127.28 2.68 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.944 -1.263 . . . . 0.0 109.944 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -54.37 -28.69 44.87 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.033 -1.275 . . . . 0.0 110.169 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -58.46 -33.87 70.23 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 120.99 -1.068 . . . . 0.0 110.464 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -50.47 -38.71 45.35 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.925 -1.109 . . . . 0.0 110.75 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -63.16 -54.28 40.08 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.104 -0.998 . . . . 0.0 108.945 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -60.13 -38.98 84.69 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.11 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.11 -38.33 70.61 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.24 -0.913 . . . . 0.0 110.117 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CE1' ' A' ' 8' ' ' TYR . 73.5 t -59.14 -37.32 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.062 -1.024 . . . . 0.0 109.879 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.3 ttpp -53.41 -39.97 64.73 Favored 'General case' 0 N--CA 1.513 2.724 0 O-C-N 120.887 -1.133 . . . . 0.0 109.845 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -58.47 -30.79 67.25 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.293 -0.879 . . . . 0.0 110.222 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -68.05 -53.26 27.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.984 -1.072 . . . . 0.0 109.967 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.7 p90 -100.08 33.29 2.66 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.097 -1.002 . . . . 0.0 111.248 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -73.62 -39.11 64.8 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.771 -1.205 . . . . 0.0 110.112 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -110.16 32.35 5.2 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.553 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.444 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.7 t90 -107.27 -57.9 2.02 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.152 -0.968 . . . . 0.0 110.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.444 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 ttm -140.5 63.08 1.48 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.271 -0.893 . . . . 0.0 109.627 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -45.17 -34.15 2.59 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.363 -0.836 . . . . 0.0 111.587 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -81.35 129.41 34.61 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.042 -1.036 . . . . 0.0 109.32 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 54.71 71.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.976 -1.078 . . . . 0.0 110.213 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -131.25 -174.02 3.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.362 -0.836 . . . . 0.0 110.445 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.429 ' CG ' ' OH ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 56.76 34.03 23.95 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.346 -0.846 . . . . 0.0 110.542 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.96 -56.57 2.31 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.11 -0.993 . . . . 0.0 109.368 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -22.2 62.12 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.223 -0.923 . . . . 0.0 111.213 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.13 -42.78 96.66 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 120.702 -1.249 . . . . 0.0 108.991 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.73 -37.25 73.25 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.335 -0.853 . . . . 0.0 110.391 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -72.1 -34.55 68.73 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.617 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.4 m . . . . . 0 N--CA 1.506 2.373 0 O-C-N 121.006 -1.059 . . . . 0.0 110.167 179.919 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 mttt . . . . . 0 N--CA 1.501 2.115 0 CA-C-O 120.939 0.4 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.401 ' CD2' ' OD1' ' A' ' 16' ' ' ASP . 77.5 t80 -125.57 162.45 24.91 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.128 -0.982 . . . . 0.0 110.137 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -131.91 135.71 46.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.226 -0.921 . . . . 0.0 110.535 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -112.79 95.55 5.48 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.175 -0.953 . . . . 0.0 109.731 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.85 -35.24 31.51 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.16 -0.962 . . . . 0.0 110.725 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 74.3 m-85 -63.54 -30.64 71.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.094 -1.004 . . . . 0.0 110.155 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.6 m -100.01 -8.83 23.38 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.968 -1.082 . . . . 0.0 112.107 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 t0 55.91 40.64 30.5 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.368 -1.458 . . . . 0.0 110.121 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.04 173.64 11.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.313 -0.867 . . . . 0.0 109.957 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -120.64 131.13 54.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.685 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mp -88.42 172.04 9.67 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.239 -0.913 . . . . 0.0 109.567 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.42 HG21 ' CG ' ' A' ' 15' ' ' HIS . 15.0 t -98.3 -31.93 11.8 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.148 -0.97 . . . . 0.0 111.469 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.42 ' CG ' HG21 ' A' ' 14' ' ' THR . 28.1 m-70 -121.04 134.65 55.29 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.807 -1.183 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.401 ' OD1' ' CD2' ' A' ' 4' ' ' PHE . 24.0 t0 -113.06 97.27 6.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.149 -0.97 . . . . 0.0 109.895 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.34 179.4 1.18 Allowed Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.225 -0.922 . . . . 0.0 110.015 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.19 -31.32 14.69 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.303 1.16 . . . . 0.0 110.853 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.8 t -86.16 -38.97 17.15 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.923 -1.11 . . . . 0.0 110.069 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 80.7 t -67.61 -46.35 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.119 -0.988 . . . . 0.0 109.751 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.0 mtp180 -56.92 -52.34 65.57 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.054 -1.028 . . . . 0.0 109.757 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -60.67 -40.19 91.21 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.156 -0.965 . . . . 0.0 108.871 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.6 m -55.09 -43.37 73.89 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.101 -0.999 . . . . 0.0 108.515 178.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -62.29 -38.48 89.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.396 -0.815 . . . . 0.0 109.004 178.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -94.92 52.81 1.51 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.22 -0.925 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -117.66 39.47 3.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 109.899 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -132.78 160.11 23.71 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -88.32 -10.99 47.64 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.334 -1.098 . . . . 0.0 110.83 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtpp -91.14 -24.35 19.99 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.582 -1.324 . . . . 0.0 111.212 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -48.9 -38.51 22.86 Favored 'General case' 0 N--CA 1.517 2.897 0 O-C-N 120.813 -1.179 . . . . 0.0 110.813 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -64.94 -54.41 31.04 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.24 -0.984 . . . . 0.0 108.906 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.03 -39.26 89.13 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.229 -0.92 . . . . 0.0 109.073 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -56.98 -37.18 71.27 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.13 -0.981 . . . . 0.0 110.021 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 71.8 t -55.85 -37.98 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 O-C-N 120.975 -1.078 . . . . 0.0 110.079 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.0 tttt -58.98 -42.96 91.21 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.057 -1.027 . . . . 0.0 109.293 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -59.35 -26.3 64.93 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.467 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -74.43 -51.92 13.54 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.875 -1.141 . . . . 0.0 110.426 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 34.4 p90 -99.41 31.98 2.93 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.057 -1.027 . . . . 0.0 111.495 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -76.16 -40.25 52.98 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.724 -1.235 . . . . 0.0 110.131 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mttp -84.65 -32.04 23.86 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.248 -0.908 . . . . 0.0 110.182 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 5.9 t90 -50.21 -45.31 53.63 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.971 -1.081 . . . . 0.0 111.058 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.468 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -114.72 -55.3 2.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 110.341 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 53.65 38.34 28.1 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.978 -1.076 . . . . 0.0 110.739 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -157.55 -56.66 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.183 -0.948 . . . . 0.0 110.761 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -164.18 82.77 0.42 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.165 -0.959 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -138.77 72.53 1.41 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.29 36.63 4.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.259 -0.901 . . . . 0.0 110.277 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.39 -53.85 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.148 -0.97 . . . . 0.0 109.745 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.37 -21.41 62.1 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.255 -0.903 . . . . 0.0 111.522 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.414 HD13 ' CE2' ' A' ' 38' ' ' TYR . 47.6 mm -71.75 -50.68 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 O-C-N 120.608 -1.308 . . . . 0.0 109.521 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -64.86 -39.39 93.48 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.274 -0.891 . . . . 0.0 109.915 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -33.43 64.26 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.095 -1.003 . . . . 0.0 110.731 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.505 2.28 0 O-C-N 120.968 -1.083 . . . . 0.0 110.682 179.988 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.4 mttt . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 75.2 t80 -108.04 161.45 14.94 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.28 -0.888 . . . . 0.0 110.164 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -135.05 137.45 42.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.283 -0.886 . . . . 0.0 110.002 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.7 t -119.26 96.91 5.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.101 -0.999 . . . . 0.0 110.294 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.87 -35.9 62.05 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.053 -1.029 . . . . 0.0 110.293 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.6 m-85 -60.59 -32.89 71.98 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.122 -0.986 . . . . 0.0 110.117 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.2 m -97.34 -4.37 38.69 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.061 -1.025 . . . . 0.0 112.198 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 53.45 39.4 29.9 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.376 -1.452 . . . . 0.0 110.573 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.76 170.06 16.4 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.294 -0.879 . . . . 0.0 109.992 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -118.41 134.05 55.38 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.322 -0.861 . . . . 0.0 110.423 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -90.09 161.81 15.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.191 -0.943 . . . . 0.0 109.664 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.7 t -98.69 -21.95 16.16 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.101 -0.999 . . . . 0.0 111.888 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -115.28 143.94 44.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.635 -1.291 . . . . 0.0 110.11 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -125.78 92.29 3.57 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 109.715 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.57 178.57 1.45 Allowed Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.229 -0.919 . . . . 0.0 110.043 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -70.82 -28.67 19.84 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.438 1.23 . . . . 0.0 111.078 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.2 OUTLIER -91.61 -41.6 10.67 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.882 -1.136 . . . . 0.0 110.004 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 97.9 t -59.44 -54.05 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.093 -1.005 . . . . 0.0 109.728 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 20.4 mtp-105 -56.17 -50.52 70.95 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.163 -0.961 . . . . 0.0 109.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -61.99 -40.44 95.64 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.334 -0.946 . . . . 0.0 108.818 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 19' ' ' SER . 67.4 m -54.5 -43.07 71.49 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.117 -0.989 . . . . 0.0 108.368 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -62.45 -37.55 86.33 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.392 -0.818 . . . . 0.0 108.886 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -99.26 45.17 1.0 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.261 -0.899 . . . . 0.0 110.448 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -116.6 38.14 3.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.215 -0.928 . . . . 0.0 110.182 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.17 128.71 3.79 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.9 ttp85 -55.38 -27.49 47.87 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.225 -1.162 . . . . 0.0 110.545 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -62.53 -33.53 75.09 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.996 -1.065 . . . . 0.0 110.669 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -51.32 -39.0 56.0 Favored 'General case' 0 N--CA 1.516 2.851 0 O-C-N 120.877 -1.139 . . . . 0.0 110.508 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -63.21 -55.1 27.81 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.35 -0.94 . . . . 0.0 109.057 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.01 -39.52 86.1 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.211 -0.93 . . . . 0.0 109.111 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -56.6 -38.27 71.79 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.17 -0.956 . . . . 0.0 110.012 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE1' ' A' ' 8' ' ' TYR . 71.5 t -56.73 -35.01 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.121 -0.987 . . . . 0.0 110.123 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 33.6 tttt -53.32 -44.57 68.5 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.812 -1.18 . . . . 0.0 109.932 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.42 -28.89 65.67 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.282 -0.887 . . . . 0.0 110.407 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -74.31 -50.75 17.53 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.947 -1.096 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 37.9 p90 -99.31 34.42 2.18 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.029 -1.044 . . . . 0.0 111.451 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -90.97 -41.21 11.25 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.723 -1.235 . . . . 0.0 109.656 178.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -112.53 32.83 5.33 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.346 -0.846 . . . . 0.0 110.26 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 16.2 t90 -97.7 -41.87 7.89 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.185 -0.947 . . . . 0.0 110.439 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.462 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -115.69 -67.96 0.96 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.063 -1.023 . . . . 0.0 110.108 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -167.17 -60.66 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.15 -0.969 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.21 -51.52 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.074 -1.016 . . . . 0.0 111.093 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -81.12 89.0 5.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.111 -0.993 . . . . 0.0 110.3 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.401 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -145.78 69.42 1.22 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.236 -0.915 . . . . 0.0 110.136 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -122.32 35.38 4.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.552 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -108.16 -52.68 2.73 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.194 -0.941 . . . . 0.0 109.499 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -20.94 63.34 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 111.478 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.442 HG21 HD11 ' A' ' 50' ' ' ILE . 48.6 mm -74.77 -56.18 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 120.699 -1.251 . . . . 0.0 109.806 179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -56.97 -39.43 74.59 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.167 -0.958 . . . . 0.0 110.312 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -57.13 -36.47 70.73 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.117 -0.99 . . . . 0.0 110.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.505 2.284 0 O-C-N 121.063 -1.023 . . . . 0.0 110.541 179.806 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.417 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 16.8 mtmt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -110.88 152.07 27.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.221 -0.924 . . . . 0.0 109.629 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -128.95 136.0 49.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.2 t -110.15 94.5 5.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 110.168 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -51.73 -35.57 43.72 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.051 -1.03 . . . . 0.0 110.459 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 78.3 m-85 -61.85 -32.2 72.51 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.174 -0.953 . . . . 0.0 110.057 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.4 m -98.29 -0.96 42.92 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.993 -1.067 . . . . 0.0 112.146 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 52.25 38.87 25.87 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.407 -1.433 . . . . 0.0 110.69 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -140.21 171.23 14.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 109.978 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.4 OUTLIER -122.1 119.14 30.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.205 -0.935 . . . . 0.0 110.145 -179.758 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -75.99 166.71 23.09 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.145 -0.972 . . . . 0.0 109.489 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.8 t -100.37 -30.38 11.88 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.153 -0.967 . . . . 0.0 111.725 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -112.44 142.18 45.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.732 -1.23 . . . . 0.0 110.154 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.41 89.71 3.18 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.184 -0.948 . . . . 0.0 109.714 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -136.59 178.44 1.74 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.847 . . . . 0.0 110.046 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.53 -29.94 19.46 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 23' ' ' THR . 67.8 m -90.32 -43.63 10.22 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.923 -1.11 . . . . 0.0 109.91 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.58 -53.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.632 0 O-C-N 121.184 -0.948 . . . . 0.0 109.789 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 mtp-105 -56.76 -50.22 72.91 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.145 -0.972 . . . . 0.0 109.699 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -61.93 -40.29 94.98 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.316 -0.954 . . . . 0.0 108.802 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 19' ' ' SER . 64.7 m -54.53 -42.66 71.16 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.013 -1.054 . . . . 0.0 108.684 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -61.69 -37.63 84.83 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.167 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.32 53.12 1.47 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.234 -0.916 . . . . 0.0 110.423 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.71 38.22 3.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.1 -1.0 . . . . 0.0 110.101 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.25 130.01 4.45 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 -59.29 -23.98 62.88 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.231 -1.158 . . . . 0.0 110.854 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -71.06 -27.48 63.67 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 120.819 -1.176 . . . . 0.0 111.45 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -49.55 -37.89 28.88 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.735 -1.228 . . . . 0.0 110.806 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -63.17 -54.2 41.38 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.087 -1.008 . . . . 0.0 109.112 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -60.46 -40.14 90.14 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.144 -0.972 . . . . 0.0 109.057 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -55.98 -37.22 68.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.223 -0.923 . . . . 0.0 110.046 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 73.8 t -55.92 -33.64 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.589 0 O-C-N 121.129 -0.982 . . . . 0.0 110.291 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 5.0 tttt -53.2 -41.94 65.79 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.825 -1.172 . . . . 0.0 109.994 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.56 -27.77 64.89 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.437 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.02 -52.26 13.3 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.877 -1.139 . . . . 0.0 110.499 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.01 31.63 2.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.004 -1.06 . . . . 0.0 111.656 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.59 -38.3 59.2 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.661 -1.274 . . . . 0.0 110.027 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.7 mttt -113.28 34.24 4.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.255 -0.903 . . . . 0.0 110.563 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -98.21 -47.12 5.58 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -148.14 -63.63 0.25 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.352 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -120.24 -177.29 3.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.305 -0.872 . . . . 0.0 110.251 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -97.72 -37.73 9.77 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.19 -0.943 . . . . 0.0 110.68 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -109.72 112.33 24.33 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.049 -1.032 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -148.74 76.74 1.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.217 -0.927 . . . . 0.0 110.242 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -106.48 35.71 2.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.063 -1.023 . . . . 0.0 110.462 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.9 -55.17 2.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.069 -1.019 . . . . 0.0 109.276 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.262 -0.899 . . . . 0.0 111.316 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.6 mm -70.37 -44.78 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.7 -1.25 . . . . 0.0 109.514 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -58.13 -40.8 82.2 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.189 -0.944 . . . . 0.0 110.029 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -61.19 -34.91 75.84 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.234 -0.916 . . . . 0.0 110.483 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m . . . . . 0 N--CA 1.505 2.293 0 O-C-N 120.979 -1.076 . . . . 0.0 110.174 179.917 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 mttt . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -111.86 162.66 15.05 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.269 -0.894 . . . . 0.0 110.01 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -137.75 137.1 37.94 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.033 -1.042 . . . . 0.0 110.853 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.2 t -114.23 100.74 8.58 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.177 -0.952 . . . . 0.0 109.91 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -58.09 -37.08 73.83 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.098 -1.002 . . . . 0.0 110.704 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CD1' HG12 ' A' ' 34' ' ' VAL . 25.0 m-85 -61.4 -34.96 76.23 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 120.996 -1.065 . . . . 0.0 110.046 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.6 m -90.03 -4.12 57.58 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.095 -1.003 . . . . 0.0 111.826 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.9 t70 53.74 39.4 30.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.393 -1.442 . . . . 0.0 110.473 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.18 171.89 13.44 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.279 -0.888 . . . . 0.0 109.995 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.4 120.81 37.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.243 -0.911 . . . . 0.0 110.086 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.7 166.91 22.81 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.13 -0.981 . . . . 0.0 109.559 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.9 t -101.12 -29.44 12.13 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.106 -0.996 . . . . 0.0 111.889 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -114.62 148.11 38.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.782 -1.199 . . . . 0.0 110.342 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -124.59 97.52 5.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.203 -0.936 . . . . 0.0 109.764 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.423 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.29 178.08 1.56 Allowed Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.226 -0.921 . . . . 0.0 110.263 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -70.56 -30.67 18.24 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 O-C-N 123.405 1.213 . . . . 0.0 110.93 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.404 ' O ' ' OG1' ' A' ' 23' ' ' THR . 27.7 m -90.32 -39.78 12.52 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.978 -1.076 . . . . 0.0 109.989 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.5 t -60.2 -52.34 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.034 -1.041 . . . . 0.0 109.509 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -57.61 -49.39 76.56 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 121.13 -0.981 . . . . 0.0 109.583 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -41.4 99.09 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.728 178.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.404 ' OG1' ' O ' ' A' ' 19' ' ' SER . 78.8 m -54.59 -43.33 72.05 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.157 -0.964 . . . . 0.0 108.493 178.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.87 -37.16 85.76 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.648 -0.821 . . . . 0.0 109.062 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 50.32 1.04 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.206 -0.934 . . . . 0.0 110.331 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.22 38.11 3.32 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.057 -1.027 . . . . 0.0 110.382 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.34 126.41 2.39 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.836 -1.305 . . . . 0.0 109.836 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -53.75 -28.92 37.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.211 -1.17 . . . . 0.0 110.263 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -59.13 -32.74 70.12 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.05 -1.031 . . . . 0.0 110.605 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -49.54 -37.08 25.6 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.92 -1.112 . . . . 0.0 111.043 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -60.67 -53.62 55.27 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.071 -1.018 . . . . 0.0 109.157 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -39.03 85.52 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.181 -0.95 . . . . 0.0 109.03 178.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -56.03 -37.16 68.83 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.281 -0.887 . . . . 0.0 110.18 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CD1' ' A' ' 8' ' ' TYR . 96.3 t -58.83 -37.2 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.06 -1.025 . . . . 0.0 109.796 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 38' ' ' TYR . 9.0 tttp -54.76 -40.83 69.77 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.93 -1.106 . . . . 0.0 109.716 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.59 -32.4 70.35 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.95 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -65.51 -51.32 60.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.997 -1.064 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 45.8 p90 -99.87 34.21 2.35 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.06 -1.025 . . . . 0.0 111.323 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -39.21 15.87 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.813 -1.179 . . . . 0.0 109.733 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -114.27 34.55 4.63 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.237 -0.914 . . . . 0.0 110.358 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.459 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.6 t90 -88.5 -47.61 8.2 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.181 -0.949 . . . . 0.0 110.162 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.459 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -151.98 -64.18 0.17 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.182 -0.949 . . . . 0.0 110.639 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -129.24 -171.48 2.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.221 -0.924 . . . . 0.0 110.147 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -109.52 -179.74 3.91 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.22 -0.925 . . . . 0.0 110.14 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 53.27 74.56 0.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.121 -0.987 . . . . 0.0 110.687 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -135.23 73.5 1.48 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.271 -0.893 . . . . 0.0 110.166 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -112.18 35.19 3.86 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.203 -0.936 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.09 -54.21 2.56 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.054 -1.029 . . . . 0.0 109.325 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -21.24 63.1 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.268 -0.895 . . . . 0.0 111.334 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.455 HD11 HG22 ' A' ' 50' ' ' ILE . 48.1 mm -74.05 -43.31 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.646 -1.284 . . . . 0.0 109.536 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -64.53 -39.97 94.76 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.234 -0.916 . . . . 0.0 109.978 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -63.58 -33.64 76.05 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.229 -0.92 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.4 m . . . . . 0 N--CA 1.505 2.315 0 O-C-N 121.066 -1.021 . . . . 0.0 110.39 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.9 mttt . . . . . 0 N--CA 1.502 2.141 0 CA-C-O 121.002 0.429 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -124.89 162.21 24.9 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.11 -0.994 . . . . 0.0 109.912 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -139.7 132.43 29.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.231 -0.918 . . . . 0.0 110.434 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 t -112.84 89.88 3.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.204 -0.935 . . . . 0.0 109.973 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -51.31 -35.77 39.41 Favored 'General case' 0 N--CA 1.515 2.82 0 O-C-N 121.05 -1.031 . . . . 0.0 110.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.431 ' CE2' HG12 ' A' ' 34' ' ' VAL . 88.0 m-85 -59.92 -31.0 69.42 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.117 -0.99 . . . . 0.0 110.063 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.3 m -99.41 -0.15 41.48 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.929 -1.107 . . . . 0.0 112.239 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 52.84 38.41 26.63 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.326 -1.484 . . . . 0.0 110.656 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -142.16 170.46 15.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.224 -0.923 . . . . 0.0 110.022 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -121.45 142.92 49.56 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.212 -0.93 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -102.73 156.58 17.54 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.251 -0.906 . . . . 0.0 109.406 179.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 t -98.86 -30.83 12.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.13 -0.981 . . . . 0.0 111.594 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -111.19 126.93 55.38 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.814 -1.179 . . . . 0.0 110.175 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -110.03 92.52 4.08 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.237 -0.915 . . . . 0.0 109.647 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.42 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -135.61 -179.72 1.15 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.43 -0.794 . . . . 0.0 109.765 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.72 -28.35 17.13 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.185 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -90.84 -43.55 9.97 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.881 -1.137 . . . . 0.0 110.07 179.606 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.14 -53.29 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.57 0 O-C-N 121.039 -1.038 . . . . 0.0 109.838 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.95 -50.14 73.54 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.074 -1.016 . . . . 0.0 109.625 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -61.91 -40.8 96.7 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.133 -0.98 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 81.6 m -54.56 -43.43 72.03 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.075 -1.016 . . . . 0.0 108.496 178.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -63.35 -40.91 98.57 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -93.25 56.61 2.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.342 -0.849 . . . . 0.0 110.197 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -119.11 37.09 4.23 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.131 -0.981 . . . . 0.0 110.401 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.29 123.37 1.74 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -51.12 -30.39 16.18 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.204 -1.174 . . . . 0.0 110.672 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -57.66 -33.79 68.7 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.013 -1.054 . . . . 0.0 110.596 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -50.49 -42.43 54.68 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.92 -1.113 . . . . 0.0 110.728 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -62.97 -53.31 56.07 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.107 -0.996 . . . . 0.0 109.055 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.68 88.89 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.232 -0.918 . . . . 0.0 109.04 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -55.66 -38.61 69.82 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.215 -0.928 . . . . 0.0 110.024 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' CE2' ' A' ' 8' ' ' TYR . 75.4 t -61.62 -38.76 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 121.176 -0.952 . . . . 0.0 109.662 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 12.8 mtmt -58.45 -45.24 88.96 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.053 -1.029 . . . . 0.0 109.395 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.92 -25.66 63.66 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.274 -0.891 . . . . 0.0 110.362 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -72.9 -50.78 21.62 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.84 -1.162 . . . . 0.0 110.583 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 37.6 p90 -99.85 34.88 2.15 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.994 -1.067 . . . . 0.0 111.464 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -38.96 14.22 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.769 -1.207 . . . . 0.0 109.871 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.42 32.02 6.07 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.268 -0.895 . . . . 0.0 110.663 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.44 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 17.4 t90 -85.39 -37.93 19.29 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.126 -0.984 . . . . 0.0 110.315 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.44 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 1.9 mtm -142.48 -67.36 0.38 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.103 -0.998 . . . . 0.0 110.206 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -156.98 38.82 0.31 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.095 -1.003 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 52.05 38.33 23.74 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.087 -1.008 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.37 74.8 1.55 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.104 -0.997 . . . . 0.0 110.2 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -154.83 73.44 0.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.199 -0.938 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.45 35.15 4.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.947 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.4 t -109.86 -54.74 2.53 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.154 -0.966 . . . . 0.0 109.369 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.12 -20.01 64.97 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.282 -0.886 . . . . 0.0 111.365 179.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.418 HG13 ' CE1' ' A' ' 38' ' ' TYR . 50.0 mm -74.64 -41.09 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.698 -1.251 . . . . 0.0 109.914 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.29 -39.62 86.02 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.909 . . . . 0.0 110.146 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -56.3 -37.09 69.42 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.095 -1.003 . . . . 0.0 110.47 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.0 m . . . . . 0 N--CA 1.505 2.286 0 O-C-N 121.227 -0.921 . . . . 0.0 110.567 179.843 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 41.6 mttt . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CE1' ' HD3' ' A' ' 21' ' ' ARG . 84.8 t80 -111.6 161.85 15.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.176 -0.953 . . . . 0.0 110.328 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -129.04 139.28 52.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.268 -0.895 . . . . 0.0 110.146 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -118.21 98.35 6.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.131 -0.981 . . . . 0.0 109.912 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.98 -36.05 48.47 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 121.033 -1.042 . . . . 0.0 110.75 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.419 ' CE2' HG12 ' A' ' 34' ' ' VAL . 82.2 m-85 -63.48 -30.92 71.96 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.036 -1.04 . . . . 0.0 110.254 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.0 m -99.46 -11.11 21.39 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.981 -1.075 . . . . 0.0 112.03 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t0 56.72 40.89 28.93 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.409 -1.432 . . . . 0.0 110.076 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -141.56 172.95 11.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.248 -0.907 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.415 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.5 t80 -119.92 128.41 53.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.304 -0.873 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.27 169.75 16.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.2 -0.937 . . . . 0.0 109.732 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.417 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -97.43 -31.99 12.08 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.169 -0.957 . . . . 0.0 111.346 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.417 ' CD2' HG21 ' A' ' 14' ' ' THR . 39.1 m-70 -116.04 137.6 51.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.91 -1.118 . . . . 0.0 110.126 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -114.19 96.44 5.8 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.209 -0.932 . . . . 0.0 109.838 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.36 177.96 1.61 Allowed Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.256 -0.902 . . . . 0.0 110.172 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.02 -31.21 15.34 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.372 1.196 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.411 ' O ' ' OG1' ' A' ' 23' ' ' THR . 36.6 m -87.2 -39.76 15.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.912 -1.117 . . . . 0.0 110.084 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.2 t -61.02 -47.81 91.9 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.226 -0.921 . . . . 0.0 109.716 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 20.5 mtt180 -57.53 -53.73 54.81 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.146 -0.972 . . . . 0.0 109.725 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -60.61 -40.08 90.54 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.191 -0.943 . . . . 0.0 109.009 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 19' ' ' SER . 95.1 m -56.22 -43.44 78.56 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.083 -1.011 . . . . 0.0 108.421 178.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.32 -36.87 81.34 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.028 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -97.48 49.38 1.04 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.146 -0.971 . . . . 0.0 110.389 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.82 37.76 3.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.12 -0.988 . . . . 0.0 110.284 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.61 129.51 4.02 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -54.42 -28.57 44.85 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.152 -1.205 . . . . 0.0 110.481 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -61.2 -35.16 76.43 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.996 -1.065 . . . . 0.0 110.503 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -51.68 -38.45 55.07 Favored 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.908 -1.12 . . . . 0.0 110.599 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -61.6 -55.74 27.41 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.114 -0.991 . . . . 0.0 109.245 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -58.97 -38.51 79.27 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.206 -0.934 . . . . 0.0 109.173 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.18 -38.33 70.79 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.163 -0.961 . . . . 0.0 110.128 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.419 HG12 ' CE2' ' A' ' 8' ' ' TYR . 98.2 t -63.52 -36.85 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.099 -1.001 . . . . 0.0 109.847 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -52.53 -40.58 62.62 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.007 -1.058 . . . . 0.0 109.821 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.71 -30.14 65.28 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.314 -0.866 . . . . 0.0 110.316 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.46 -53.48 19.03 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.885 -1.134 . . . . 0.0 109.946 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -100.11 34.39 2.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 111.198 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.77 -36.96 56.68 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 120.781 -1.199 . . . . 0.0 110.341 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.21 22.99 13.1 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.101 -0.999 . . . . 0.0 111.294 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.8 t90 -104.89 -49.46 3.49 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.865 -1.147 . . . . 0.0 110.238 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.469 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -103.54 -46.7 4.48 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.127 -0.983 . . . . 0.0 110.299 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 53.7 38.5 28.55 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.984 -1.073 . . . . 0.0 110.775 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -156.93 -65.82 0.1 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.634 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -164.69 77.68 0.33 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.18 -0.95 . . . . 0.0 110.788 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.84 73.7 1.16 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.166 -0.959 . . . . 0.0 110.431 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.1 35.9 4.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.284 -0.885 . . . . 0.0 110.388 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.0 m -111.21 -52.9 2.75 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.106 -0.996 . . . . 0.0 109.798 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.2 -21.3 61.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.134 -0.979 . . . . 0.0 111.551 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.4 mm -70.75 -38.61 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 120.719 -1.238 . . . . 0.0 109.778 179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -86.62 -39.97 15.6 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.106 -0.996 . . . . 0.0 110.065 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -64.27 -31.79 73.13 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.222 -0.924 . . . . 0.0 110.652 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.3 m . . . . . 0 N--CA 1.505 2.304 0 O-C-N 120.964 -1.085 . . . . 0.0 110.418 -179.901 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.2 mttp . . . . . 0 N--CA 1.501 2.116 0 CA-C-O 120.925 0.393 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -126.38 162.36 25.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.103 -0.998 . . . . 0.0 110.093 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -141.25 132.01 25.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -0.956 . . . . 0.0 110.393 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.4 t -110.63 88.87 2.88 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.203 -0.935 . . . . 0.0 109.553 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -50.96 -36.48 39.15 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.153 -0.967 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.441 ' CD2' ' CG1' ' A' ' 34' ' ' VAL . 26.6 m-85 -61.79 -30.55 70.89 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.041 -1.037 . . . . 0.0 110.127 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.0 m -98.15 -0.88 43.46 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.997 -1.064 . . . . 0.0 111.997 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 53.01 38.27 26.82 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.423 -1.423 . . . . 0.0 110.791 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.9 t -139.59 168.05 20.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.155 -0.966 . . . . 0.0 109.872 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -120.91 143.77 48.78 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.155 -0.966 . . . . 0.0 110.637 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.25 140.23 39.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -102.33 -21.03 14.38 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.074 -1.016 . . . . 0.0 112.441 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -103.58 67.49 0.9 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.636 -1.29 . . . . 0.0 110.02 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.44 101.7 0.11 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.24 -0.912 . . . . 0.0 110.038 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.72 178.18 1.57 Allowed Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.026 -1.046 . . . . 0.0 110.251 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.88 -30.17 17.46 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.403 1.212 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.423 ' O ' ' OG1' ' A' ' 23' ' ' THR . 40.3 m -90.26 -40.77 11.96 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.888 -1.133 . . . . 0.0 109.961 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.1 t -59.6 -56.16 19.06 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.626 0 O-C-N 121.053 -1.029 . . . . 0.0 109.75 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.7 mtp85 -55.27 -50.28 69.92 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.072 -1.017 . . . . 0.0 109.899 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -62.34 -40.64 97.04 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.285 -0.966 . . . . 0.0 108.802 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 19' ' ' SER . 52.9 m -55.5 -43.08 75.32 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.097 -1.002 . . . . 0.0 108.368 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -64.73 -37.79 88.78 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.6 -0.84 . . . . 0.0 108.953 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -97.63 57.0 1.33 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.171 -0.956 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.13 37.73 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.129 -0.982 . . . . 0.0 110.443 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.13 122.69 1.25 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.84 -29.61 28.88 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.091 -1.241 . . . . 0.0 110.134 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -56.78 -31.99 65.21 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -47.34 -38.64 13.29 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.132 -0.98 . . . . 0.0 111.306 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -55.06 26.74 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.006 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -59.49 -39.1 82.68 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.183 -0.948 . . . . 0.0 109.092 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -54.64 -36.38 64.47 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.194 -0.941 . . . . 0.0 110.261 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.441 ' CG1' ' CD2' ' A' ' 8' ' ' TYR . 89.1 t -55.34 -37.81 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.733 0 O-C-N 121.056 -1.027 . . . . 0.0 110.093 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 7.1 tttp -54.26 -39.67 67.07 Favored 'General case' 0 N--CA 1.514 2.737 0 O-C-N 121.073 -1.017 . . . . 0.0 109.894 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -59.8 -32.26 70.47 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.036 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 33.5 t80 -64.87 -52.17 58.06 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.954 -1.091 . . . . 0.0 110.169 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 49.3 p90 -100.38 34.69 2.31 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.097 -1.002 . . . . 0.0 111.15 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.6 14.56 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.736 -1.228 . . . . 0.0 109.788 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.36 34.47 4.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.247 -0.908 . . . . 0.0 110.415 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.436 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.7 t90 -93.5 -38.82 11.21 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.153 -0.967 . . . . 0.0 110.273 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.436 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.3 ttm -145.87 -62.19 0.33 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.177 -0.952 . . . . 0.0 110.392 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -143.35 -164.46 1.87 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.182 -0.949 . . . . 0.0 110.05 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.29 39.26 2.34 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.111 -0.993 . . . . 0.0 110.201 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -150.41 75.1 1.21 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.418 ' HB1' ' CD1' ' A' ' 38' ' ' TYR . . . -139.47 72.1 1.39 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.214 -0.928 . . . . 0.0 110.181 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.06 35.92 4.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.343 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -110.28 -54.94 2.52 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.147 -0.97 . . . . 0.0 109.309 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -21.06 64.12 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.204 -0.935 . . . . 0.0 111.208 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.425 HG13 ' CE2' ' A' ' 38' ' ' TYR . 48.3 mm -74.36 -54.59 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.653 -1.28 . . . . 0.0 109.517 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -55.56 -39.67 70.94 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.14 -0.975 . . . . 0.0 110.3 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.7 tttt -59.74 -37.15 78.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.128 -0.983 . . . . 0.0 110.304 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 m . . . . . 0 N--CA 1.504 2.264 0 O-C-N 121.064 -1.022 . . . . 0.0 110.076 179.83 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 5.7 mttt . . . . . 0 N--CA 1.494 1.772 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CE2' ' CD ' ' A' ' 21' ' ' ARG . 57.9 t80 -110.72 161.49 15.71 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.128 -0.983 . . . . 0.0 110.491 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 34.7 t80 -135.58 134.58 39.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.225 -0.922 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 39.3 t -114.27 96.67 5.91 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.125 -0.984 . . . . 0.0 110.1 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -53.52 -36.2 61.5 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.075 -1.016 . . . . 0.0 110.468 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.426 ' CE2' HG12 ' A' ' 34' ' ' VAL . 90.9 m-85 -61.45 -32.76 72.75 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.138 -0.976 . . . . 0.0 110.074 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.9 m -96.51 -5.33 39.68 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.996 -1.065 . . . . 0.0 112.187 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 53.44 39.86 30.53 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.441 -1.412 . . . . 0.0 110.388 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -141.62 172.09 13.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.332 -0.855 . . . . 0.0 109.956 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.408 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 13.0 t80 -119.41 137.89 53.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.315 -0.866 . . . . 0.0 110.479 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 mp -96.59 168.29 10.62 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.237 -0.915 . . . . 0.0 109.587 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.406 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.2 t -98.88 -30.13 12.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.166 -0.958 . . . . 0.0 111.777 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 14' ' ' THR . 49.5 m-70 -113.06 148.73 34.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.909 -1.119 . . . . 0.0 110.413 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -126.56 96.88 4.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.338 -0.851 . . . . 0.0 109.678 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.46 178.5 1.49 Allowed Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.258 -0.901 . . . . 0.0 110.283 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.43 -32.01 16.55 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.37 1.195 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.41 ' O ' ' OG1' ' A' ' 23' ' ' THR . 50.2 m -86.07 -40.34 15.83 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 120.929 -1.107 . . . . 0.0 109.878 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.94 -50.2 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.194 -0.941 . . . . 0.0 109.496 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.446 ' CD ' ' CE2' ' A' ' 4' ' ' PHE . 36.2 mtm-85 -57.45 -50.24 73.67 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.49 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.49 -40.91 96.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.139 -0.976 . . . . 0.0 108.674 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.1 m -54.57 -43.69 72.29 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.122 -0.987 . . . . 0.0 108.463 178.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -62.77 -39.99 95.89 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -93.07 55.75 2.4 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.267 -0.896 . . . . 0.0 110.35 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.89 37.29 4.25 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.063 -1.023 . . . . 0.0 110.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.87 126.95 2.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -28.3 42.98 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.126 -1.22 . . . . 0.0 110.462 179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -60.94 -32.4 71.92 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.972 -1.08 . . . . 0.0 110.708 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -50.22 -39.95 45.98 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.946 -1.096 . . . . 0.0 110.75 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 -52.81 60.1 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.071 -1.018 . . . . 0.0 108.89 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -61.26 -39.73 91.45 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.481 -0.888 . . . . 0.0 108.918 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -56.29 -38.56 71.39 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.237 -0.915 . . . . 0.0 109.981 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' CE2' ' A' ' 8' ' ' TYR . 73.5 t -56.84 -35.47 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.646 0 O-C-N 121.091 -1.005 . . . . 0.0 110.027 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.0 tttt -53.07 -42.82 66.22 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.999 -1.063 . . . . 0.0 109.935 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -57.51 -31.35 65.94 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.196 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -64.31 -51.3 64.13 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.991 -1.068 . . . . 0.0 110.148 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.2 p90 -100.37 33.62 2.63 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.152 -0.967 . . . . 0.0 111.352 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -91.16 -38.52 12.68 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.801 -1.187 . . . . 0.0 110.054 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -111.28 29.11 8.1 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.221 -0.924 . . . . 0.0 110.894 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.438 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 25.9 t90 -92.56 -40.07 11.0 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.002 -1.061 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.438 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.0 tpp -145.8 -60.4 0.33 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.073 -1.017 . . . . 0.0 110.286 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.32 -164.63 2.02 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.199 -0.938 . . . . 0.0 110.242 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -109.89 39.39 2.14 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.198 -0.939 . . . . 0.0 110.134 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -152.0 75.89 1.16 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.158 -0.964 . . . . 0.0 110.36 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.401 ' HB1' ' CD2' ' A' ' 38' ' ' TYR . . . -138.94 74.29 1.47 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.237 -0.914 . . . . 0.0 110.272 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -111.89 35.86 3.54 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.191 -0.943 . . . . 0.0 110.341 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.4 p -110.48 -53.78 2.65 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.172 -0.955 . . . . 0.0 109.547 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.31 63.3 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.252 -0.905 . . . . 0.0 111.322 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 48.1 mm -73.27 -54.5 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 120.61 -1.306 . . . . 0.0 109.552 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -57.29 -39.49 75.83 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.185 -0.947 . . . . 0.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -63.85 -35.08 79.46 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.218 -0.926 . . . . 0.0 110.458 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.5 m . . . . . 0 N--CA 1.504 2.262 0 O-C-N 121.028 -1.045 . . . . 0.0 110.235 179.949 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.402 ' O ' ' CD1' ' A' ' 12' ' ' TYR . 62.6 t80 -115.08 154.68 28.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.192 -0.943 . . . . 0.0 109.868 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 11' ' ' THR . 66.2 t80 -130.93 141.03 50.25 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.007 -1.058 . . . . 0.0 110.563 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.2 t -119.15 92.61 3.84 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.289 -0.882 . . . . 0.0 109.793 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -53.09 -36.48 60.75 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.093 -1.005 . . . . 0.0 111.064 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CD1' HG12 ' A' ' 34' ' ' VAL . 25.0 m-85 -62.15 -32.58 73.2 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 120.997 -1.064 . . . . 0.0 109.957 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 45.9 m -94.73 -1.33 53.2 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.989 -1.069 . . . . 0.0 111.934 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.88 38.27 28.34 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.304 -1.498 . . . . 0.0 110.439 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.406 ' O ' ' CD1' ' A' ' 5' ' ' TYR . 8.3 t -143.38 171.53 14.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.164 -0.96 . . . . 0.0 110.011 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.7 OUTLIER -129.86 131.26 46.04 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 109.954 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -87.99 161.67 17.27 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.117 -0.989 . . . . 0.0 110.145 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -97.22 -29.98 13.26 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.998 -1.064 . . . . 0.0 111.6 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -106.88 130.77 54.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.903 -1.123 . . . . 0.0 109.974 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -114.18 76.89 1.01 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.165 -0.959 . . . . 0.0 110.002 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -119.87 -179.11 0.65 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.278 -0.889 . . . . 0.0 109.934 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.83 -26.56 15.6 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.292 1.154 . . . . 0.0 111.507 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.41 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.1 t -92.06 -42.71 9.81 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.752 -1.218 . . . . 0.0 110.196 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.4 t -57.82 -53.12 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.018 . . . . 0.0 109.932 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 mtp180 -55.98 -51.12 68.84 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.023 -1.048 . . . . 0.0 109.809 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -61.98 -40.8 96.85 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.143 -0.973 . . . . 0.0 108.728 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.5 m -54.64 -43.03 71.96 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.215 -0.928 . . . . 0.0 108.504 178.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -62.88 -37.8 88.34 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 119.627 -0.829 . . . . 0.0 108.979 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -97.26 51.39 1.1 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.224 -0.922 . . . . 0.0 110.2 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.32 37.99 3.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.355 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.4 127.76 2.84 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.52 -28.33 44.57 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.205 -1.173 . . . . 0.0 110.496 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -61.12 -33.15 72.92 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.88 -1.138 . . . . 0.0 110.669 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -50.33 -41.34 51.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.933 -1.105 . . . . 0.0 110.87 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -61.79 -56.08 23.27 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.236 179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -59.0 -38.02 78.23 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.159 -0.963 . . . . 0.0 109.157 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -56.35 -39.35 72.73 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.113 -0.992 . . . . 0.0 110.041 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG12 ' CD1' ' A' ' 8' ' ' TYR . 84.2 t -62.86 -39.28 84.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 109.544 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -59.59 -42.45 92.6 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.058 -1.026 . . . . 0.0 109.215 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.42 -31.48 69.31 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.062 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -69.85 -51.73 30.97 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.922 -1.111 . . . . 0.0 110.249 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 42.3 p90 -99.88 33.89 2.44 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.073 -1.017 . . . . 0.0 111.34 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -39.73 17.46 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.78 -1.2 . . . . 0.0 109.874 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -90.34 -29.65 17.94 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.25 -0.906 . . . . 0.0 110.372 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.436 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 8.1 t90 -46.6 -33.89 4.53 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.086 -1.009 . . . . 0.0 111.788 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.436 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 1.5 mtt -151.77 -55.22 0.14 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.992 -1.068 . . . . 0.0 111.198 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 59.26 40.08 21.82 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.902 -1.124 . . . . 0.0 110.027 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -147.41 85.91 1.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.224 -0.922 . . . . 0.0 110.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 53.55 74.22 0.33 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.001 -1.062 . . . . 0.0 110.635 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -143.4 69.45 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.21 -0.931 . . . . 0.0 110.207 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -129.95 32.75 4.5 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 0.0 110.634 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.6 m -102.89 -48.21 4.14 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.055 -1.028 . . . . 0.0 109.605 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -21.64 61.84 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.184 -0.948 . . . . 0.0 111.42 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.428 HG13 ' CZ ' ' A' ' 38' ' ' TYR . 50.5 mm -83.47 -40.84 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.368 0 O-C-N 120.601 -1.312 . . . . 0.0 109.938 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.72 -40.35 83.47 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.168 -0.958 . . . . 0.0 110.09 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.31 -35.51 67.62 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.581 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.1 m . . . . . 0 N--CA 1.504 2.263 0 O-C-N 121.047 -1.033 . . . . 0.0 110.531 179.793 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.5 mttt . . . . . 0 N--CA 1.495 1.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.408 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 47.8 t80 -111.1 157.08 20.42 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.131 -0.981 . . . . 0.0 110.144 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -129.72 137.88 50.82 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.201 -0.937 . . . . 0.0 110.31 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.9 t -115.59 96.36 5.59 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.206 -0.934 . . . . 0.0 110.223 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -54.02 -36.35 62.9 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.057 -1.027 . . . . 0.0 110.341 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.419 ' CD2' HG12 ' A' ' 34' ' ' VAL . 82.7 m-85 -60.26 -33.97 73.07 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.071 -1.018 . . . . 0.0 110.039 179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.0 m -94.73 0.88 55.36 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.118 -0.989 . . . . 0.0 112.036 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.49 37.56 19.76 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.468 -1.395 . . . . 0.0 110.797 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -146.26 171.26 15.22 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.24 -0.913 . . . . 0.0 110.173 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.17 124.55 47.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.043 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.41 167.15 21.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.228 -0.92 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.0 t -101.12 -28.46 12.68 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.139 -0.976 . . . . 0.0 111.951 -179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -111.22 144.67 40.0 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.726 -1.234 . . . . 0.0 110.167 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -123.09 92.58 3.73 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 109.887 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -141.82 178.26 1.59 Allowed Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.243 -0.911 . . . . 0.0 110.047 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.43 -30.81 14.8 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.465 1.245 . . . . 0.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.422 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.3 t -89.96 -40.5 12.32 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.947 -1.096 . . . . 0.0 109.991 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.3 t -58.96 -53.17 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.125 -0.985 . . . . 0.0 109.787 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.408 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 32.9 mtm180 -56.81 -51.57 68.46 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.075 -1.016 . . . . 0.0 109.735 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -61.82 -40.17 94.34 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.286 -0.966 . . . . 0.0 108.968 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 19' ' ' SER . 73.6 m -55.4 -42.61 74.29 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.053 -1.029 . . . . 0.0 108.482 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.93 -36.35 83.14 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.348 -0.845 . . . . 0.0 109.172 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.69 46.37 0.97 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.172 -0.955 . . . . 0.0 110.448 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.58 38.51 3.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.108 -0.995 . . . . 0.0 110.199 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.34 126.49 2.6 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -28.27 45.41 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.185 -1.186 . . . . 0.0 110.287 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -58.35 -33.95 70.11 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.894 -1.128 . . . . 0.0 110.479 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -50.45 -37.65 39.41 Favored 'General case' 0 N--CA 1.516 2.834 0 O-C-N 120.963 -1.086 . . . . 0.0 110.733 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -55.56 28.58 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.027 -1.046 . . . . 0.0 109.126 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.19 -39.25 82.01 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.238 -0.914 . . . . 0.0 109.179 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.53 -37.43 70.45 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.218 -0.926 . . . . 0.0 110.072 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.419 HG12 ' CD2' ' A' ' 8' ' ' TYR . 87.2 t -57.9 -37.67 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.023 -1.048 . . . . 0.0 109.944 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 21.0 tttp -54.32 -40.43 67.95 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.947 -1.095 . . . . 0.0 109.669 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -58.37 -28.97 65.63 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.24 -0.913 . . . . 0.0 110.276 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -70.93 -54.32 11.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.882 -1.136 . . . . 0.0 109.996 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.6 p90 -99.01 27.77 4.82 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.159 -0.963 . . . . 0.0 111.536 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -62.92 -36.8 84.57 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.699 -1.251 . . . . 0.0 110.381 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -109.29 28.51 8.44 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.192 -0.942 . . . . 0.0 111.019 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.442 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 18.6 t90 -103.42 -49.77 3.62 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.089 -1.007 . . . . 0.0 110.041 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.442 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 1.3 ttm -148.94 -57.51 0.21 Allowed 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.203 -0.935 . . . . 0.0 110.413 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 55.03 -165.51 0.11 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.924 -1.11 . . . . 0.0 110.388 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 53.41 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.036 -1.04 . . . . 0.0 110.371 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 55.49 69.92 0.69 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.979 -1.076 . . . . 0.0 110.338 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.82 69.05 1.07 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.239 -0.913 . . . . 0.0 110.375 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -131.6 33.0 4.07 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.285 -0.884 . . . . 0.0 110.71 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.8 p -103.76 -49.9 3.54 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.097 -1.002 . . . . 0.0 109.389 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.15 -21.11 63.46 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.24 -0.912 . . . . 0.0 111.319 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.5 mm -82.8 -40.15 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 120.723 -1.236 . . . . 0.0 109.951 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.58 -40.7 48.8 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -57.07 -33.33 67.16 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.076 -1.015 . . . . 0.0 110.652 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 78.0 m . . . . . 0 N--CA 1.503 2.221 0 O-C-N 120.968 -1.082 . . . . 0.0 110.34 -179.979 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.426 ' CD1' ' HG2' ' A' ' 21' ' ' ARG . 89.6 t80 -107.08 161.54 14.66 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.225 -0.922 . . . . 0.0 109.992 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -137.76 137.36 38.19 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.114 -0.991 . . . . 0.0 110.222 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 t -120.71 92.84 3.86 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.258 -0.901 . . . . 0.0 110.043 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -52.7 -36.16 56.85 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.041 -1.037 . . . . 0.0 110.424 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.429 ' CE1' HG12 ' A' ' 34' ' ' VAL . 90.6 m-85 -60.13 -33.81 72.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.087 -1.008 . . . . 0.0 110.01 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.8 m -94.21 -2.54 52.34 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.101 -0.999 . . . . 0.0 112.129 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.57 40.45 31.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.38 -1.45 . . . . 0.0 110.554 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.8 t -145.93 169.95 17.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.246 -0.909 . . . . 0.0 110.328 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -120.86 140.58 51.58 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.166 -0.959 . . . . 0.0 110.688 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.2 mp -97.04 164.42 12.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 t -101.48 -21.83 14.68 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.127 -0.983 . . . . 0.0 112.319 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -121.83 137.33 54.82 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.596 -1.315 . . . . 0.0 110.198 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -116.09 88.28 2.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.184 -0.947 . . . . 0.0 109.845 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.414 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -132.5 178.54 1.71 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.265 -0.897 . . . . 0.0 109.898 -179.617 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -70.88 -28.27 20.09 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.39 1.205 . . . . 0.0 111.285 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 23' ' ' THR . 17.5 m -91.99 -43.17 9.59 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.891 -1.131 . . . . 0.0 110.125 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.8 t -58.58 -53.34 48.19 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.091 -1.006 . . . . 0.0 109.905 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.426 ' HG2' ' CD1' ' A' ' 4' ' ' PHE . 34.8 mtp180 -56.98 -50.0 74.01 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.034 -1.041 . . . . 0.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -40.53 96.62 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.122 -0.986 . . . . 0.0 108.692 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 19' ' ' SER . 87.7 m -54.0 -43.02 69.68 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.136 -0.977 . . . . 0.0 108.429 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.3 -38.65 91.98 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 119.565 -0.854 . . . . 0.0 108.822 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -98.57 47.36 0.99 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.206 -0.934 . . . . 0.0 110.466 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -115.37 40.13 2.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.14 -0.975 . . . . 0.0 109.887 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.68 147.86 19.43 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -76.88 -10.42 59.36 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.258 -1.142 . . . . 0.0 111.22 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -88.36 -26.09 22.39 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.652 -1.28 . . . . 0.0 111.079 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -49.21 -40.16 32.5 Favored 'General case' 0 N--CA 1.518 2.949 0 O-C-N 120.814 -1.179 . . . . 0.0 110.903 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -62.72 -55.62 25.03 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.104 -0.998 . . . . 0.0 109.101 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.86 -38.65 82.73 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.208 -0.932 . . . . 0.0 109.124 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -56.62 -37.28 70.5 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.14 -0.975 . . . . 0.0 110.094 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.429 HG12 ' CE1' ' A' ' 8' ' ' TYR . 47.9 t -55.97 -36.52 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.029 -1.044 . . . . 0.0 109.993 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.4 ttpm? -55.38 -41.1 72.18 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 120.899 -1.125 . . . . 0.0 109.751 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -58.51 -26.05 63.06 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.308 -0.87 . . . . 0.0 110.552 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -73.64 -52.41 13.46 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.819 -1.176 . . . . 0.0 110.438 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.9 p90 -99.08 30.79 3.27 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.036 -1.04 . . . . 0.0 111.517 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -73.98 -41.45 61.9 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.668 -1.27 . . . . 0.0 109.692 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.09 22.85 11.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.314 -0.866 . . . . 0.0 111.117 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 24.9 t90 -56.41 -48.84 76.11 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.806 -1.184 . . . . 0.0 110.276 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.435 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -139.58 34.74 2.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.933 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 50.19 37.58 15.09 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.926 -1.109 . . . . 0.0 111.02 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -143.65 -172.84 3.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 110.279 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -109.12 114.25 27.81 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -113.92 76.59 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.286 -0.884 . . . . 0.0 110.216 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -108.85 36.37 2.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.168 -0.958 . . . . 0.0 110.371 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.29 -56.08 2.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.204 -0.935 . . . . 0.0 109.424 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.89 64.42 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.196 -0.94 . . . . 0.0 111.254 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.418 HG13 ' CE2' ' A' ' 38' ' ' TYR . 46.6 mm -69.35 -41.35 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.629 -1.294 . . . . 0.0 109.509 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.08 -39.05 56.21 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.281 -0.887 . . . . 0.0 110.007 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -34.54 72.22 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.158 -0.964 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.5 m . . . . . 0 N--CA 1.505 2.321 0 O-C-N 121.024 -1.048 . . . . 0.0 110.223 179.933 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt . . . . . 0 N--CA 1.503 2.221 0 CA-C-O 121.029 0.442 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -116.72 162.16 18.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.993 -1.067 . . . . 0.0 110.353 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -135.9 133.84 38.11 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -113.52 95.53 5.4 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.143 -0.973 . . . . 0.0 110.275 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -52.87 -35.94 58.42 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.065 -1.022 . . . . 0.0 110.34 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.436 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.2 m-85 -60.74 -31.99 71.29 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.136 -0.977 . . . . 0.0 110.11 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.9 m -98.59 -4.96 32.88 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.005 -1.059 . . . . 0.0 112.255 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 t0 54.14 39.59 30.85 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.46 -1.4 . . . . 0.0 110.337 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -142.16 172.96 11.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.195 -0.941 . . . . 0.0 110.032 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -120.03 135.44 54.93 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.262 -0.898 . . . . 0.0 110.594 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -95.43 165.38 12.39 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.166 -0.959 . . . . 0.0 109.442 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.2 t -99.48 -22.16 15.62 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.063 -1.023 . . . . 0.0 112.031 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -117.17 145.95 43.51 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.721 -1.237 . . . . 0.0 110.282 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -127.81 92.85 3.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 109.569 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.426 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.81 178.93 1.28 Allowed Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.325 -0.86 . . . . 0.0 110.116 -179.529 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -70.53 -26.71 23.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.377 1.198 . . . . 0.0 111.108 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 23' ' ' THR . 4.1 m -92.66 -41.73 10.02 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.81 -1.181 . . . . 0.0 109.929 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 67.5 t -60.97 -52.49 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.128 -0.983 . . . . 0.0 109.602 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 -56.4 -50.37 71.82 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.053 -1.029 . . . . 0.0 109.558 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.25 -41.28 98.3 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.359 -0.936 . . . . 0.0 108.573 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' SER . 57.9 m -54.25 -43.68 71.12 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.081 -1.012 . . . . 0.0 108.445 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -62.22 -38.68 90.11 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.407 -0.808 . . . . 0.0 108.832 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -95.84 51.89 1.29 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.155 -0.966 . . . . 0.0 110.336 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.35 37.72 4.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.098 -1.001 . . . . 0.0 110.257 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.79 128.38 3.44 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 ttt-85 -53.83 -28.83 37.98 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.523 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -59.84 -36.35 76.67 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.925 -1.109 . . . . 0.0 110.349 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -52.16 -40.23 61.13 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.967 -1.083 . . . . 0.0 110.371 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -63.42 -55.05 27.42 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.181 -0.949 . . . . 0.0 109.069 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -60.25 -38.9 84.93 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.245 -0.909 . . . . 0.0 109.098 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -57.12 -38.84 74.02 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.156 -0.965 . . . . 0.0 109.849 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.436 HG12 ' CE1' ' A' ' 8' ' ' TYR . 72.3 t -60.15 -38.6 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.126 -0.984 . . . . 0.0 109.721 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -56.5 -49.24 75.3 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.988 -1.07 . . . . 0.0 109.445 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.72 -27.58 59.45 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.317 -0.865 . . . . 0.0 110.49 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -74.38 -50.59 17.98 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.904 -1.122 . . . . 0.0 110.548 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -99.53 34.43 2.22 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.016 -1.052 . . . . 0.0 111.552 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.4 tp60 -83.85 -40.47 18.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.726 -1.234 . . . . 0.0 109.824 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -115.02 29.43 8.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.264 -0.898 . . . . 0.0 110.83 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.3 t90 -51.27 -53.68 33.22 Favored 'General case' 0 N--CA 1.513 2.718 0 O-C-N 120.946 -1.096 . . . . 0.0 110.873 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.447 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 19.6 mtm -144.7 -71.1 0.28 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.0 110.448 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -172.64 45.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.928 -1.107 . . . . 0.0 111.126 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -165.31 -168.19 1.32 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.124 -0.985 . . . . 0.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -115.47 126.63 54.55 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.208 -0.933 . . . . 0.0 110.074 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -116.34 74.74 0.92 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.03 35.81 3.11 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.047 -1.033 . . . . 0.0 110.395 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -112.09 -53.56 2.7 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.148 -0.97 . . . . 0.0 109.843 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -20.85 63.4 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.188 -0.945 . . . . 0.0 111.545 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.8 mm -69.51 -47.61 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.677 -1.265 . . . . 0.0 109.58 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.5 -38.53 77.85 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.121 -0.987 . . . . 0.0 110.245 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -70.87 -35.31 72.32 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.13 -0.981 . . . . 0.0 110.417 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m . . . . . 0 N--CA 1.505 2.317 0 O-C-N 121.004 -1.06 . . . . 0.0 110.174 179.859 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.2 mttm . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE2' ' NH2' ' A' ' 21' ' ' ARG . 37.2 t80 -115.85 156.2 26.53 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.189 -0.944 . . . . 0.0 109.912 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -140.52 140.5 35.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.156 -0.965 . . . . 0.0 110.442 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 t -113.17 98.54 7.2 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.251 -0.905 . . . . 0.0 109.99 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -56.47 -36.55 69.21 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.204 -0.935 . . . . 0.0 110.693 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.422 ' OH ' HD12 ' A' ' 50' ' ' ILE . 24.6 m-85 -62.5 -34.5 76.98 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.047 -1.033 . . . . 0.0 110.064 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.9 m -93.41 -3.18 53.67 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.055 -1.028 . . . . 0.0 112.004 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 53.98 38.73 29.48 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.4 -1.438 . . . . 0.0 110.457 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -134.66 171.68 14.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.265 -0.897 . . . . 0.0 109.86 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.09 120.54 32.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -83.0 162.05 21.56 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.12 -0.987 . . . . 0.0 109.493 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.413 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -101.09 -31.04 11.26 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.086 -1.009 . . . . 0.0 111.848 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.413 ' CD2' HG21 ' A' ' 14' ' ' THR . 42.4 m-70 -115.23 137.6 51.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.796 -1.19 . . . . 0.0 110.427 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -116.27 89.41 3.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.252 -0.905 . . . . 0.0 109.765 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.4 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -131.63 -179.99 1.2 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.857 . . . . 0.0 109.923 -179.568 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.33 -28.92 17.67 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.419 1.221 . . . . 0.0 111.093 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.9 t -92.27 -44.25 8.85 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.889 -1.132 . . . . 0.0 110.019 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.03 -52.23 63.16 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.052 -1.03 . . . . 0.0 109.825 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.449 ' NH2' ' CE2' ' A' ' 4' ' ' PHE . 24.9 mtp85 -58.49 -50.25 74.43 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.031 -1.043 . . . . 0.0 109.552 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -61.27 -39.9 92.12 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.186 -0.946 . . . . 0.0 108.881 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 79.5 m -54.03 -42.23 68.92 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.149 -0.969 . . . . 0.0 108.681 178.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.61 -39.58 94.74 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.2 t -93.9 57.3 2.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.304 -0.873 . . . . 0.0 110.084 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.5 m -113.06 37.87 3.01 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.104 -0.998 . . . . 0.0 110.557 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.28 126.55 1.99 Allowed Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.096 -1.201 . . . . 0.0 110.096 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -55.08 -28.19 50.54 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.058 -1.26 . . . . 0.0 110.165 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -57.8 -33.9 69.06 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.888 -1.133 . . . . 0.0 110.394 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -49.45 -43.94 45.24 Favored 'General case' 0 N--CA 1.515 2.812 0 O-C-N 120.991 -1.068 . . . . 0.0 110.86 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.9 tttt -60.79 -54.08 49.55 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.061 -1.024 . . . . 0.0 109.185 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -60.03 -38.44 82.73 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.211 -0.931 . . . . 0.0 109.088 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -56.51 -37.17 70.06 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.173 -0.954 . . . . 0.0 110.198 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 ' CG1' ' CD2' ' A' ' 8' ' ' TYR . 84.0 t -61.91 -37.34 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 121.082 -1.011 . . . . 0.0 110.066 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.3 mtpt -54.24 -41.78 69.14 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.901 -1.124 . . . . 0.0 109.73 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.91 -28.89 66.62 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.291 178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -71.18 -52.16 20.75 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.924 -1.11 . . . . 0.0 110.285 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.448 ' O ' ' CD1' ' A' ' 38' ' ' TYR . 37.9 p90 -100.09 35.8 1.99 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.079 -1.013 . . . . 0.0 111.263 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -37.9 14.28 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.85 -1.156 . . . . 0.0 110.151 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -112.87 27.82 9.31 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 111.165 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.0 t90 -70.18 -43.08 71.51 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.029 -1.045 . . . . 0.0 110.019 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.429 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -151.66 36.32 0.57 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.219 -0.926 . . . . 0.0 110.746 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 50.54 38.77 19.47 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.961 -1.087 . . . . 0.0 111.088 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -140.84 -173.94 3.85 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.139 -0.976 . . . . 0.0 110.304 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -112.77 116.69 30.48 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -115.77 73.47 0.84 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.201 -0.937 . . . . 0.0 110.221 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.74 36.76 2.32 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.082 -1.011 . . . . 0.0 110.205 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.8 p -113.08 -55.63 2.5 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.118 -0.989 . . . . 0.0 109.452 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -21.65 64.33 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.183 -0.948 . . . . 0.0 111.161 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.422 HD12 ' OH ' ' A' ' 8' ' ' TYR . 44.3 mm -66.79 -41.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.618 -1.301 . . . . 0.0 109.219 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -61.17 -41.73 97.3 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.606 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -59.97 -36.49 77.22 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.189 -0.944 . . . . 0.0 110.14 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.505 2.309 0 O-C-N 121.041 -1.037 . . . . 0.0 109.998 179.789 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 mttm . . . . . 0 N--CA 1.506 2.325 0 CA-C-O 121.069 0.462 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.404 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 58.0 t80 -103.83 161.18 14.17 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.948 -1.095 . . . . 0.0 110.192 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -133.39 137.27 45.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.167 -0.958 . . . . 0.0 110.435 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.6 t -113.69 98.96 7.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.303 -0.873 . . . . 0.0 110.077 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -56.48 -36.83 69.55 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.105 -0.997 . . . . 0.0 110.256 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CD1' HG12 ' A' ' 34' ' ' VAL . 90.8 m-85 -59.7 -33.42 71.58 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 m -95.56 0.15 52.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.016 -1.052 . . . . 0.0 112.112 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 51.92 37.78 21.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.398 -1.439 . . . . 0.0 110.741 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -144.24 171.75 13.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.233 -0.917 . . . . 0.0 109.892 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.38 125.27 47.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 110.206 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.7 170.29 16.13 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.155 -0.966 . . . . 0.0 109.704 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.403 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -100.3 -31.8 11.17 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.217 -0.927 . . . . 0.0 111.681 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.403 ' CD2' HG21 ' A' ' 14' ' ' THR . 37.1 m-70 -116.54 142.21 47.17 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.83 -1.169 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -117.79 93.69 4.24 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 109.857 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.05 177.94 1.9 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 110.12 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.96 -31.11 15.69 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.426 1.224 . . . . 0.0 110.954 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.424 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -90.52 -41.77 11.21 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.021 -1.049 . . . . 0.0 110.002 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 97.2 t -59.31 -54.29 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 109.911 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 14.8 mtp-105 -56.56 -49.87 73.58 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.102 -0.999 . . . . 0.0 109.907 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -40.47 97.65 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.163 -1.015 . . . . 0.0 108.794 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 19' ' ' SER . 55.8 m -54.74 -42.68 71.9 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.08 -1.013 . . . . 0.0 108.423 178.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -62.36 -35.76 80.12 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.256 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -100.62 42.8 1.09 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.096 -1.003 . . . . 0.0 110.479 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -115.34 38.42 3.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.203 -0.936 . . . . 0.0 110.213 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.75 128.37 3.45 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -54.11 -28.7 41.29 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.227 -1.161 . . . . 0.0 110.359 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -59.24 -35.38 73.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.973 -1.079 . . . . 0.0 110.397 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -51.83 -39.04 58.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.91 -1.119 . . . . 0.0 110.473 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -62.19 -53.7 51.55 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.092 -1.005 . . . . 0.0 109.037 179.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -60.63 -39.22 87.42 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.037 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -56.26 -38.74 71.55 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' A' ' 8' ' ' TYR . 79.0 t -58.89 -38.95 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.55 0 O-C-N 121.042 -1.036 . . . . 0.0 109.597 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 1.2 tmmt? -54.47 -39.97 67.98 Favored 'General case' 0 N--CA 1.513 2.705 0 O-C-N 121.028 -1.045 . . . . 0.0 109.618 179.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.75 -33.14 69.94 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.37 -53.65 45.25 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.033 -1.042 . . . . 0.0 109.621 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.442 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 45.9 p90 -100.73 35.29 2.2 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.203 -0.936 . . . . 0.0 110.922 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.45 -35.91 53.48 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.753 -1.217 . . . . 0.0 110.293 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -102.27 21.21 15.39 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.063 -1.023 . . . . 0.0 111.402 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.432 ' CZ2' ' HE2' ' A' ' 42' ' ' MET . 8.2 t90 -106.93 -52.8 2.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.88 -1.138 . . . . 0.0 109.827 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.432 ' HE2' ' CZ2' ' A' ' 41' ' ' TRP . 2.7 mtm -142.03 54.46 1.47 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.28 -0.888 . . . . 0.0 109.817 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -50.27 -34.99 25.25 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.121 -0.987 . . . . 0.0 111.272 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.2 -61.96 1.94 Allowed 'General case' 0 N--CA 1.513 2.705 0 O-C-N 120.937 -1.102 . . . . 0.0 110.585 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -147.75 96.62 2.7 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.423 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.79 71.51 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.229 -0.919 . . . . 0.0 110.486 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 35.15 2.33 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.15 -0.969 . . . . 0.0 110.482 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.02 -52.88 2.71 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.061 -1.024 . . . . 0.0 109.578 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -20.93 64.1 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.262 -0.898 . . . . 0.0 111.334 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.441 HG21 HD11 ' A' ' 50' ' ' ILE . 49.1 mm -75.13 -39.99 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 120.622 -1.299 . . . . 0.0 109.847 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -75.76 -40.38 55.47 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.095 -1.003 . . . . 0.0 110.004 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt -57.42 -34.74 69.24 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.164 -0.96 . . . . 0.0 110.635 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.7 m . . . . . 0 N--CA 1.504 2.243 0 O-C-N 121.021 -1.05 . . . . 0.0 110.247 179.858 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.454 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 42.8 mttt . . . . . 0 N--CA 1.494 1.743 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -109.65 161.98 14.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.167 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -129.36 138.24 51.42 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.113 -0.992 . . . . 0.0 110.37 -179.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 47.4 t -117.11 96.77 5.59 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.17 -0.956 . . . . 0.0 109.967 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -51.88 -35.98 47.03 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.021 -1.05 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.436 ' CE1' HG12 ' A' ' 34' ' ' VAL . 76.9 m-85 -62.81 -31.19 72.13 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.186 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.0 m -98.02 -9.45 26.02 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.008 -1.058 . . . . 0.0 111.965 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.1 t70 56.34 41.22 29.33 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.382 -1.449 . . . . 0.0 110.014 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -146.21 174.26 11.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.281 -0.887 . . . . 0.0 110.191 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.454 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.68 138.84 51.73 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.3 -0.875 . . . . 0.0 110.623 -179.686 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.4 mp -93.79 171.31 8.95 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.137 -0.977 . . . . 0.0 109.735 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -96.67 -30.2 13.38 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.26 -0.9 . . . . 0.0 111.368 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' HG21 ' A' ' 14' ' ' THR . 49.6 m-70 -113.21 148.26 35.84 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.823 -1.173 . . . . 0.0 110.188 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -126.65 96.3 4.62 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.255 -0.903 . . . . 0.0 109.845 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -152.23 178.1 1.68 Allowed Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.234 -0.916 . . . . 0.0 110.456 -179.712 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.0 Cg_endo -70.72 -33.64 12.63 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.296 1.156 . . . . 0.0 110.74 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.7 m -84.65 -37.09 21.47 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.007 -1.058 . . . . 0.0 110.142 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.9 t -64.51 -45.81 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.084 -1.01 . . . . 0.0 109.438 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -57.27 -50.77 71.84 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.992 -1.067 . . . . 0.0 109.571 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.65 -41.4 97.46 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.69 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.4 m -54.6 -43.43 72.15 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.18 -0.95 . . . . 0.0 108.612 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -61.13 -37.61 83.41 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.452 -0.78 . . . . 0.0 109.109 178.081 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.5 t -94.21 54.65 1.91 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.119 -0.988 . . . . 0.0 110.386 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.12 38.98 3.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.087 -1.008 . . . . 0.0 110.049 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.59 163.43 23.25 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -88.96 -12.49 41.42 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.323 -1.104 . . . . 0.0 110.901 178.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.1 mmtm -91.11 -26.64 19.03 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.634 -1.291 . . . . 0.0 111.177 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -49.37 -38.66 29.3 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.836 -1.165 . . . . 0.0 110.751 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -64.83 -53.44 46.77 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.216 -0.994 . . . . 0.0 108.981 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -61.09 -39.5 90.17 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.181 -0.949 . . . . 0.0 109.028 178.553 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -56.27 -37.98 70.56 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.137 -0.977 . . . . 0.0 110.055 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.436 HG12 ' CE1' ' A' ' 8' ' ' TYR . 64.4 t -59.74 -38.28 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 O-C-N 121.113 -0.992 . . . . 0.0 109.84 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -55.11 -40.69 70.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.912 -1.118 . . . . 0.0 109.782 179.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -58.36 -32.14 68.28 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.303 -0.873 . . . . 0.0 110.133 179.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -65.31 -52.84 51.44 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.965 -1.085 . . . . 0.0 110.116 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.9 p90 -100.55 35.5 2.12 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.082 -1.011 . . . . 0.0 111.061 179.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -81.63 -37.73 27.08 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.727 -1.233 . . . . 0.0 110.297 179.205 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -112.73 21.42 15.57 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.207 -0.933 . . . . 0.0 111.587 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 17.8 t90 -61.08 -46.49 90.45 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.809 -1.182 . . . . 0.0 109.858 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.6 mtm -152.65 36.24 0.5 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.211 -0.93 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.65 46.47 25.67 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.939 -1.101 . . . . 0.0 111.055 179.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -146.33 -172.3 3.92 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.107 -0.996 . . . . 0.0 110.374 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -110.86 162.95 14.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.155 -0.966 . . . . 0.0 109.999 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -168.75 77.57 0.12 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.167 -0.958 . . . . 0.0 111.164 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -109.85 34.5 3.81 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.058 -1.026 . . . . 0.0 110.433 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.03 -57.71 2.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.182 -0.949 . . . . 0.0 109.101 179.251 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 pp -54.33 -26.34 29.1 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.195 -0.941 . . . . 0.0 111.271 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.437 HD11 HG22 ' A' ' 50' ' ' ILE . 41.5 mm -61.15 -41.51 89.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 120.646 -1.284 . . . . 0.0 109.483 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -36.29 79.53 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.229 -0.919 . . . . 0.0 110.753 -179.62 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.51 -39.61 11.84 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.059 -1.026 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.508 2.427 0 O-C-N 121.154 -0.966 . . . . 0.0 110.091 -179.878 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.409 ' HE3' ' OG1' ' A' ' 14' ' ' THR . 23.8 mttp . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 120.69 0.281 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.445 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 43.1 t80 -110.21 156.04 21.19 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.202 -0.936 . . . . 0.0 109.886 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -138.38 136.8 36.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.608 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 t -110.6 93.45 4.5 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.2 -0.938 . . . . 0.0 110.089 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -52.23 -36.23 51.82 Favored 'General case' 0 N--CA 1.513 2.703 0 O-C-N 121.072 -1.017 . . . . 0.0 110.515 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE1' HG12 ' A' ' 34' ' ' VAL . 87.5 m-85 -60.34 -32.58 71.39 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.133 -0.98 . . . . 0.0 110.025 178.979 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.1 m -97.45 -0.52 46.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.057 -1.027 . . . . 0.0 112.162 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 t70 52.73 38.93 27.62 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.383 -1.448 . . . . 0.0 110.599 -179.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -137.56 172.76 12.49 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.286 -0.884 . . . . 0.0 110.021 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.0 120.17 32.57 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.31 -0.869 . . . . 0.0 110.131 -179.759 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -82.17 146.34 29.61 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.193 -0.942 . . . . 0.0 109.612 179.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.409 ' OG1' ' HE3' ' A' ' 3' ' ' LYS . 14.1 t -104.06 -20.55 13.81 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.073 -1.017 . . . . 0.0 112.62 -179.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 -106.16 70.44 0.84 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.587 -1.32 . . . . 0.0 110.301 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -61.11 101.78 0.17 Allowed 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.197 -0.939 . . . . 0.0 109.874 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.22 176.63 2.12 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.022 -1.049 . . . . 0.0 110.314 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.83 -31.86 15.07 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.519 1.273 . . . . 0.0 110.89 179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.416 ' O ' ' OG1' ' A' ' 23' ' ' THR . 23.5 m -91.1 -39.78 11.97 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.953 -1.092 . . . . 0.0 110.222 179.605 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.0 t -60.01 -49.18 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.568 0 O-C-N 121.155 -0.966 . . . . 0.0 109.663 179.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.445 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 16.5 mtp180 -58.56 -51.73 68.64 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.079 -1.013 . . . . 0.0 109.609 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -40.6 97.6 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.262 -0.975 . . . . 0.0 108.818 179.014 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 19' ' ' SER . 93.8 m -56.0 -42.88 77.08 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.077 -1.014 . . . . 0.0 108.37 178.316 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -63.53 -36.38 83.59 Favored 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.152 178.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 t -100.16 43.85 1.04 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.138 -0.976 . . . . 0.0 110.473 -179.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.77 38.49 3.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.182 -0.949 . . . . 0.0 110.138 179.773 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.95 127.32 2.97 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -54.63 -28.33 46.07 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.087 -1.243 . . . . 0.0 110.226 178.955 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -58.92 -33.63 70.79 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.991 -1.068 . . . . 0.0 110.681 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -50.84 -38.44 49.01 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.876 -1.14 . . . . 0.0 110.705 -179.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -63.65 -53.03 57.83 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.135 -0.978 . . . . 0.0 108.942 179.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.98 -39.89 91.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.239 -0.913 . . . . 0.0 108.944 178.642 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -56.11 -38.12 70.34 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.211 -0.931 . . . . 0.0 110.083 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE1' ' A' ' 8' ' ' TYR . 79.3 t -57.58 -36.8 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.069 -1.019 . . . . 0.0 110.032 179.626 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.9 tttt -53.02 -40.96 64.24 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.924 -1.11 . . . . 0.0 109.892 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -58.79 -29.67 67.0 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.223 178.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -68.55 -52.4 32.28 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.976 -1.078 . . . . 0.0 110.257 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 43.4 p90 -100.09 33.58 2.58 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.004 -1.06 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.46 -64.71 1.11 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.791 -1.193 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -64.42 -34.64 78.65 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.304 -0.873 . . . . 0.0 110.086 179.421 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 8.5 t90 -52.52 -48.07 66.28 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.041 -1.037 . . . . 0.0 111.278 -179.453 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -105.82 -45.22 4.44 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.02 -1.05 . . . . 0.0 111.26 -179.308 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 53.4 37.63 25.97 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.974 -1.079 . . . . 0.0 110.704 -179.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -160.75 -66.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.222 -0.924 . . . . 0.0 110.83 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -158.54 104.87 1.82 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.264 -0.897 . . . . 0.0 110.809 -179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -145.79 70.67 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.24 -0.912 . . . . 0.0 110.326 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -120.46 36.76 4.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.373 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.7 -53.71 2.67 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.195 -0.941 . . . . 0.0 109.654 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.35 -21.05 63.66 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.196 -0.94 . . . . 0.0 111.464 179.537 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.42 HD13 ' CD1' ' A' ' 38' ' ' TYR . 48.5 mm -72.61 -40.1 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 120.626 -1.296 . . . . 0.0 109.777 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -65.67 -40.15 92.11 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.124 -0.985 . . . . 0.0 109.971 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -64.18 -35.2 80.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.136 -0.977 . . . . 0.0 110.502 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.7 m . . . . . 0 N--CA 1.504 2.251 0 O-C-N 121.008 -1.057 . . . . 0.0 110.131 179.812 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.7 mtmm . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 120.691 0.281 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.441 ' CE1' ' NH1' ' A' ' 21' ' ' ARG . 42.3 t80 -114.75 156.43 24.84 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.965 . . . . 0.0 109.921 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -136.08 135.94 39.77 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.104 -0.997 . . . . 0.0 110.561 -179.733 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 t -111.63 93.82 4.66 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.224 -0.922 . . . . 0.0 110.202 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -52.64 -35.85 55.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.115 -0.991 . . . . 0.0 110.379 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 34' ' ' VAL . 79.7 m-85 -60.86 -32.85 72.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.176 -0.952 . . . . 0.0 110.098 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.3 m -96.95 -0.71 47.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.991 -1.068 . . . . 0.0 112.084 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t70 53.07 38.64 27.88 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.367 -1.458 . . . . 0.0 110.656 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -139.43 171.68 13.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.147 -0.971 . . . . 0.0 110.036 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.17 120.39 34.08 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.184 -0.947 . . . . 0.0 110.032 -179.66 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -78.25 166.14 23.06 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.161 -0.962 . . . . 0.0 109.558 179.43 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 t -102.22 -30.43 11.11 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.085 -1.009 . . . . 0.0 112.013 -179.367 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.5 m-70 -113.72 139.78 48.8 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.682 -1.261 . . . . 0.0 110.5 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -116.13 94.98 4.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.359 -0.838 . . . . 0.0 109.765 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.24 176.53 2.25 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.234 -0.916 . . . . 0.0 110.169 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.49 -30.33 23.71 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 O-C-N 123.386 1.203 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' OG1' ' A' ' 23' ' ' THR . 4.5 t -88.01 -41.47 13.09 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.931 -1.105 . . . . 0.0 109.974 179.65 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.3 t -59.82 -50.47 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.187 -0.946 . . . . 0.0 109.787 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' NH1' ' CE1' ' A' ' 4' ' ' PHE . 19.4 mtt180 -58.06 -51.73 68.46 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.053 -1.029 . . . . 0.0 109.611 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -60.85 -40.58 93.43 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.958 178.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 19' ' ' SER . 97.0 m -55.36 -43.04 74.7 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 121.145 -0.972 . . . . 0.0 108.507 178.316 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -64.37 -39.71 94.4 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.425 -0.797 . . . . 0.0 108.95 178.148 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.17 56.53 2.54 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.145 -0.972 . . . . 0.0 110.274 -179.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 37.86 3.57 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.049 -1.032 . . . . 0.0 110.403 179.815 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.49 125.2 2.01 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -54.71 -27.96 44.5 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.174 -1.192 . . . . 0.0 110.359 179.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 tptt -60.62 -31.78 70.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.933 -1.104 . . . . 0.0 110.764 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -49.83 -42.59 47.61 Favored 'General case' 0 N--CA 1.517 2.892 0 O-C-N 120.884 -1.135 . . . . 0.0 110.865 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -62.7 -52.56 62.81 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.116 -0.99 . . . . 0.0 109.109 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -61.4 -40.23 93.62 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.194 -0.941 . . . . 0.0 108.894 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -56.27 -37.94 70.5 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.324 -0.86 . . . . 0.0 109.914 179.083 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 8' ' ' TYR . 78.2 t -55.95 -34.52 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.602 0 O-C-N 121.05 -1.031 . . . . 0.0 110.141 179.632 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -54.82 -42.92 72.47 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.858 -1.151 . . . . 0.0 109.763 179.421 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.39 -27.97 64.76 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 178.904 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.03 -52.08 26.98 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.891 -1.131 . . . . 0.0 110.325 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 40.6 p90 -99.69 32.53 2.82 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.991 -1.068 . . . . 0.0 111.404 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -82.49 -38.46 23.85 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.728 -1.233 . . . . 0.0 109.805 178.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.5 tttp -109.28 31.35 5.81 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.234 -0.916 . . . . 0.0 110.548 179.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.466 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 7.8 t90 -85.84 -40.49 15.92 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.062 -1.024 . . . . 0.0 110.134 -179.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.466 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 14.8 ptp -176.59 -43.69 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.139 -0.976 . . . . 0.0 112.038 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -116.62 176.8 4.95 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.677 -1.264 . . . . 0.0 110.452 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -101.12 -42.72 6.26 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.277 -0.89 . . . . 0.0 110.594 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -105.04 83.49 1.99 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.039 -1.038 . . . . 0.0 110.198 179.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -117.13 75.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.204 -0.935 . . . . 0.0 110.107 -179.99 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.44 35.63 3.11 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 110.461 179.598 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -110.29 -54.31 2.59 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.126 -0.984 . . . . 0.0 109.401 179.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -20.96 64.21 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.203 -0.936 . . . . 0.0 111.297 179.18 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.43 HD11 HG22 ' A' ' 50' ' ' ILE . 47.6 mm -71.81 -46.32 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.646 -1.284 . . . . 0.0 109.446 179.615 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.56 -38.47 84.65 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.236 -0.915 . . . . 0.0 110.028 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -35.06 64.89 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.045 -1.034 . . . . 0.0 110.659 -179.855 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 N--CA 1.504 2.239 0 O-C-N 121.041 -1.037 . . . . 0.0 110.303 179.919 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.413 ' CB ' ' CE2' ' A' ' 12' ' ' TYR . 25.4 mttt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CE2' ' HD3' ' A' ' 21' ' ' ARG . 69.8 t80 -112.78 162.01 16.25 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -131.08 136.74 48.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.466 -179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.3 t -116.16 98.37 6.58 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.264 -0.898 . . . . 0.0 109.826 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -51.82 -35.92 46.05 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.015 -1.053 . . . . 0.0 110.782 -179.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' HG12 ' A' ' 34' ' ' VAL . 78.9 m-85 -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.088 -1.008 . . . . 0.0 110.291 179.4 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.0 m -97.29 -10.49 25.6 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.097 -1.002 . . . . 0.0 111.881 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 55.91 40.78 30.48 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.462 -1.399 . . . . 0.0 110.172 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -142.11 170.72 15.19 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.22 -0.925 . . . . 0.0 109.984 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.413 ' CE2' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.17 125.21 50.84 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.265 -0.897 . . . . 0.0 110.398 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.61 170.68 16.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.203 -0.936 . . . . 0.0 109.72 179.67 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.411 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.1 t -96.91 -30.49 13.09 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.204 -0.935 . . . . 0.0 111.334 -179.793 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.411 ' CD2' HG21 ' A' ' 14' ' ' THR . 47.5 m-70 -113.69 146.44 39.82 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.875 -1.141 . . . . 0.0 110.205 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -125.95 93.52 3.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.123 -0.985 . . . . 0.0 109.727 179.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -146.73 179.75 1.11 Allowed Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.511 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -71.75 -32.12 12.1 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.341 1.18 . . . . 0.0 110.935 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.8 OUTLIER -86.06 -39.21 17.03 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.949 -1.094 . . . . 0.0 109.95 179.476 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.61 -47.48 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.12 -0.987 . . . . 0.0 109.609 179.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HD3' ' CE2' ' A' ' 4' ' ' PHE . 23.9 mtt180 -57.62 -52.58 64.82 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.038 -1.039 . . . . 0.0 109.714 179.765 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -60.03 -39.84 87.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.128 -0.982 . . . . 0.0 108.943 178.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.3 m -55.08 -43.78 74.26 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.051 -1.031 . . . . 0.0 108.4 178.267 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -62.25 -37.46 85.53 Favored 'General case' 0 N--CA 1.504 2.252 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.34 48.46 0.99 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.216 -0.927 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.05 38.27 3.23 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.087 -1.008 . . . . 0.0 110.245 179.805 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.89 127.66 2.86 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -54.21 -28.52 41.52 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.106 -1.232 . . . . 0.0 110.32 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -58.68 -35.5 72.7 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.058 -1.026 . . . . 0.0 110.462 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -51.74 -40.7 60.7 Favored 'General case' 0 N--CA 1.515 2.788 0 O-C-N 121.03 -1.044 . . . . 0.0 110.427 -179.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -63.06 -52.22 63.61 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.123 -0.986 . . . . 0.0 108.819 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.65 -39.92 93.06 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.185 -0.947 . . . . 0.0 108.868 178.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -56.21 -38.58 71.22 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.961 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.433 HG12 ' CD2' ' A' ' 8' ' ' TYR . 70.6 t -58.56 -38.89 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.125 -0.984 . . . . 0.0 109.712 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.6 mtmp? -57.29 -44.83 84.37 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.059 -1.025 . . . . 0.0 109.261 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.7 -31.81 64.85 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.339 -0.851 . . . . 0.0 110.051 178.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -64.07 -53.16 54.19 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.98 -1.075 . . . . 0.0 109.769 179.729 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 45.2 p90 -99.69 28.03 4.98 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.111 -0.993 . . . . 0.0 111.602 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -56.45 -41.0 75.74 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.637 -1.29 . . . . 0.0 110.064 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -126.94 28.42 5.81 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.248 -0.908 . . . . 0.0 111.199 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 17.1 t90 -52.59 -36.28 55.82 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.903 -1.123 . . . . 0.0 110.805 -179.72 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.454 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -138.35 -67.71 0.46 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.143 -0.973 . . . . 0.0 110.398 179.908 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -170.93 -52.01 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.092 -1.005 . . . . 0.0 111.138 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.08 -168.83 2.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.224 -0.922 . . . . 0.0 109.771 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -95.62 144.51 26.0 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.088 -1.008 . . . . 0.0 110.25 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.64 84.52 2.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.224 -0.923 . . . . 0.0 110.333 -179.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -105.49 34.39 3.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 110.598 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.8 p -112.5 -55.04 2.56 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.112 -0.993 . . . . 0.0 109.314 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.06 -21.62 61.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.3 -0.875 . . . . 0.0 111.403 179.225 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.403 HD11 HG22 ' A' ' 50' ' ' ILE . 46.4 mm -68.93 -48.38 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.58 -1.325 . . . . 0.0 109.395 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.99 -39.18 80.99 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.165 -0.96 . . . . 0.0 110.191 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -56.48 -36.61 69.31 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.211 -0.931 . . . . 0.0 110.72 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.504 2.233 0 O-C-N 121.096 -1.002 . . . . 0.0 110.406 179.971 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -110.85 161.5 15.74 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.14 -0.975 . . . . 0.0 110.188 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -137.4 133.26 34.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.914 . . . . 0.0 110.194 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.1 t -113.91 94.64 4.92 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.118 -0.989 . . . . 0.0 110.173 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -52.85 -35.9 58.12 Favored 'General case' 0 N--CA 1.513 2.689 0 O-C-N 121.025 -1.047 . . . . 0.0 110.478 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CE2' HG12 ' A' ' 34' ' ' VAL . 82.0 m-85 -60.59 -32.91 71.99 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.159 -0.963 . . . . 0.0 110.106 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.9 m -96.63 -3.89 42.0 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.063 -1.023 . . . . 0.0 112.181 -179.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 t70 53.69 39.12 29.8 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.383 -1.448 . . . . 0.0 110.458 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -141.98 170.72 15.18 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.217 -0.927 . . . . 0.0 109.914 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -119.49 136.74 54.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 mp -96.26 161.88 13.76 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.267 -0.895 . . . . 0.0 109.578 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 t -98.57 -21.81 16.29 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.076 -1.015 . . . . 0.0 111.81 -179.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 51.6 m-70 -114.37 143.99 44.0 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.709 -1.245 . . . . 0.0 110.022 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -125.67 92.54 3.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 109.715 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.43 177.9 1.62 Allowed Pre-proline 0 N--CA 1.496 1.868 0 O-C-N 121.279 -0.888 . . . . 0.0 110.214 -179.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.51 -33.26 14.04 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.395 1.208 . . . . 0.0 110.775 179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 44.5 m -84.2 -39.2 19.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.956 -1.09 . . . . 0.0 110.035 179.569 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.1 t -64.38 -45.93 94.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.061 -1.024 . . . . 0.0 109.451 179.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 -59.71 -52.28 66.17 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.175 -0.953 . . . . 0.0 109.351 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -59.55 -39.67 84.74 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.137 -0.977 . . . . 0.0 108.908 178.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.4 m -55.39 -43.68 75.41 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.143 -0.973 . . . . 0.0 108.406 178.318 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.49 -40.4 96.99 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 t -92.5 56.95 2.84 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.285 -0.884 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.36 37.9 3.4 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.086 -1.009 . . . . 0.0 110.378 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.43 123.68 1.6 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -29.65 29.7 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.104 -1.233 . . . . 0.0 110.192 178.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 ptpt -57.12 -32.87 66.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.724 179.781 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -49.82 -41.76 45.54 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.978 -1.076 . . . . 0.0 110.737 -179.612 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -62.68 -54.45 39.11 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.16 -0.962 . . . . 0.0 108.986 179.167 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.43 -39.67 88.27 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.108 178.713 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -56.76 -37.6 71.27 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.227 -0.921 . . . . 0.0 110.018 179.118 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.43 HG12 ' CE2' ' A' ' 8' ' ' TYR . 73.5 t -56.67 -35.95 47.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.041 -1.037 . . . . 0.0 110.268 179.71 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.7 ttmm -57.35 -44.89 84.69 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.86 -1.15 . . . . 0.0 109.677 179.357 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.29 -25.13 63.86 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.479 178.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.41 -50.44 15.86 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.832 -1.167 . . . . 0.0 110.676 -179.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 34.5 p90 -99.49 32.96 2.61 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.976 -1.077 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -83.97 -38.43 20.99 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.715 -1.24 . . . . 0.0 109.927 178.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -112.01 32.21 5.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.117 -0.989 . . . . 0.0 110.583 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.6 t90 -90.82 -39.2 12.49 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.152 -0.968 . . . . 0.0 110.094 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -150.58 -63.26 0.2 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.224 -0.923 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -140.47 -171.67 3.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.56 39.3 2.13 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.173 -0.955 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -147.37 74.71 1.34 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.229 -0.92 . . . . 0.0 110.241 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.74 72.49 1.37 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.248 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 36.36 3.89 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.284 -0.885 . . . . 0.0 110.322 179.643 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -111.04 -54.9 2.56 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -20.17 65.29 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.24 -0.912 . . . . 0.0 111.285 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG21 HD11 ' A' ' 50' ' ' ILE . 49.1 mm -72.79 -52.95 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 O-C-N 120.719 -1.238 . . . . 0.0 109.705 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.63 -40.25 86.99 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.197 -0.939 . . . . 0.0 110.075 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 tptp -56.21 -32.23 64.21 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.075 -1.015 . . . . 0.0 110.802 -179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 m . . . . . 0 N--CA 1.507 2.395 0 O-C-N 120.961 -1.087 . . . . 0.0 110.816 -179.883 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.7 mttt . . . . . 0 N--CA 1.495 1.796 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -115.48 162.12 17.63 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.186 -0.946 . . . . 0.0 110.101 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -140.12 132.51 28.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.157 -0.965 . . . . 0.0 110.284 -179.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.4 t -113.66 90.09 3.25 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.21 -0.932 . . . . 0.0 109.967 179.403 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -51.65 -35.75 43.37 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.029 -1.044 . . . . 0.0 110.348 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.442 ' CD2' ' CG1' ' A' ' 34' ' ' VAL . 87.1 m-85 -59.56 -31.65 69.63 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.978 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.8 m -98.24 0.02 44.92 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.016 -1.053 . . . . 0.0 112.258 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t0 52.63 38.9 27.2 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.381 -1.45 . . . . 0.0 110.666 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -143.21 172.15 13.12 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.32 -0.862 . . . . 0.0 110.029 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -123.6 139.73 53.71 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.287 -0.883 . . . . 0.0 110.871 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -100.44 163.09 12.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.264 -0.897 . . . . 0.0 109.36 179.314 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.72 -30.91 11.46 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.064 -1.022 . . . . 0.0 111.849 -179.247 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.415 ' CD2' HG21 ' A' ' 14' ' ' THR . 47.9 m-70 -113.02 134.89 54.31 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.792 -1.193 . . . . 0.0 110.3 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -115.39 82.43 1.75 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.178 -0.951 . . . . 0.0 109.776 179.731 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.32 -179.93 1.03 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.288 -0.882 . . . . 0.0 110.008 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.24 -29.37 17.32 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.364 1.192 . . . . 0.0 111.099 179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.9 t -88.84 -46.31 9.04 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.867 -1.145 . . . . 0.0 110.033 179.546 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.2 t -58.55 -55.09 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.133 -0.98 . . . . 0.0 109.98 179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -55.55 -50.83 68.99 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.067 -1.021 . . . . 0.0 109.85 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.5 mttm -61.88 -39.85 93.34 Favored 'General case' 0 N--CA 1.506 2.36 0 C-N-CA 119.298 -0.961 . . . . 0.0 108.867 178.781 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 19' ' ' SER . 74.0 m -54.88 -42.95 72.71 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.11 -0.994 . . . . 0.0 108.433 178.267 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -62.25 -39.51 93.1 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.887 178.119 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -94.7 53.22 1.6 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.287 -0.883 . . . . 0.0 110.417 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.34 39.83 3.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.088 -1.008 . . . . 0.0 109.992 179.648 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.13 154.07 21.44 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -83.83 -10.26 58.17 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.327 -1.102 . . . . 0.0 111.074 178.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttm -90.51 -24.36 20.67 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.696 -1.253 . . . . 0.0 111.115 179.471 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -48.63 -38.75 21.86 Favored 'General case' 0 N--CA 1.517 2.911 0 O-C-N 120.767 -1.208 . . . . 0.0 110.853 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -65.53 -53.78 37.36 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.275 -0.97 . . . . 0.0 108.83 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.29 -39.33 90.05 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.17 -0.956 . . . . 0.0 108.981 178.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -56.66 -37.16 70.43 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.21 -0.931 . . . . 0.0 110.167 179.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.442 ' CG1' ' CD2' ' A' ' 8' ' ' TYR . 58.0 t -58.62 -43.4 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.024 -1.047 . . . . 0.0 109.726 179.837 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 24.1 ttmt -62.32 -43.25 99.25 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.986 179.086 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -60.61 -24.43 65.49 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.295 178.625 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -75.81 -51.83 11.73 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.764 -1.21 . . . . 0.0 110.452 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 32.8 p90 -98.94 28.99 4.02 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.002 -1.061 . . . . 0.0 111.643 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.08 -41.41 97.32 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.66 -1.275 . . . . 0.0 109.664 179.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -117.49 25.91 10.09 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.362 -0.836 . . . . 0.0 111.162 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.415 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.2 t90 -56.87 -39.25 73.98 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.963 -1.085 . . . . 0.0 110.344 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.415 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.2 ttm -147.03 33.55 0.91 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 49.79 37.59 13.64 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.955 -1.091 . . . . 0.0 111.258 179.692 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -145.01 -171.64 3.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.157 -0.964 . . . . 0.0 110.408 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -111.02 128.42 55.85 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.186 -0.946 . . . . 0.0 110.057 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.4 75.82 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.286 -0.884 . . . . 0.0 110.314 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.99 35.64 3.17 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.195 -0.94 . . . . 0.0 110.319 179.411 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.9 t -111.26 -55.58 2.48 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.151 -0.968 . . . . 0.0 109.294 179.277 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -20.84 65.53 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.229 -0.92 . . . . 0.0 111.118 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.0 mm -71.91 -49.09 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.668 -1.27 . . . . 0.0 109.546 179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -41.37 80.57 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.123 -0.986 . . . . 0.0 109.939 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.4 mmtm -59.95 -34.98 73.98 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.159 -0.963 . . . . 0.0 110.478 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.8 m . . . . . 0 N--CA 1.503 2.206 0 O-C-N 120.996 -1.065 . . . . 0.0 110.518 -179.937 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -112.16 162.55 15.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.161 -0.962 . . . . 0.0 110.466 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -132.22 139.65 48.39 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.15 -0.969 . . . . 0.0 110.223 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -121.06 96.86 5.26 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.08 -1.013 . . . . 0.0 110.098 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -53.53 -36.4 61.74 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.061 -1.024 . . . . 0.0 110.407 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.425 ' CE1' HG12 ' A' ' 34' ' ' VAL . 84.8 m-85 -60.7 -32.02 71.27 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.095 -1.003 . . . . 0.0 110.125 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.9 m -96.82 -6.07 36.88 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.966 -1.084 . . . . 0.0 112.126 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 54.17 39.45 30.73 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.453 -1.405 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.4 t -144.71 169.92 17.08 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.267 -0.895 . . . . 0.0 110.021 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -115.84 130.94 57.04 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.205 -0.934 . . . . 0.0 110.425 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.88 169.3 14.25 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.183 -0.948 . . . . 0.0 109.756 179.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -100.81 -21.83 15.03 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.195 -0.941 . . . . 0.0 112.108 -179.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -126.26 143.44 51.15 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.616 -1.303 . . . . 0.0 110.315 -179.909 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -120.79 92.04 3.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.06 178.21 1.74 Allowed Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.227 -0.921 . . . . 0.0 109.985 -179.55 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -70.66 -29.43 19.58 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.394 1.207 . . . . 0.0 111.114 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.411 ' O ' ' OG1' ' A' ' 23' ' ' THR . 4.7 t -90.96 -41.61 11.03 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.899 -1.126 . . . . 0.0 110.033 179.612 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.7 t -60.11 -49.82 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.807 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -57.96 -51.67 68.68 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.066 -1.021 . . . . 0.0 109.661 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -61.81 -40.37 95.03 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.16 -0.962 . . . . 0.0 108.799 178.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 19' ' ' SER . 97.5 m -55.16 -43.1 73.95 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.142 -0.974 . . . . 0.0 108.382 178.237 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -63.07 -38.97 93.31 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.66 50.97 1.14 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.22 -0.925 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.7 m -117.79 37.73 3.85 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.096 -1.002 . . . . 0.0 110.313 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.77 126.95 2.77 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.2 ttt85 -54.4 -28.44 43.61 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.235 -1.156 . . . . 0.0 110.319 179.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -59.2 -34.76 72.54 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.96 -1.088 . . . . 0.0 110.35 179.861 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -51.14 -40.19 58.0 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.912 -1.117 . . . . 0.0 110.514 -179.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -63.33 -54.68 33.24 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.263 -0.975 . . . . 0.0 109.025 179.182 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.69 -39.52 88.81 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 178.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -57.01 -37.76 72.14 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.199 -0.938 . . . . 0.0 110.035 179.18 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.425 HG12 ' CE1' ' A' ' 8' ' ' TYR . 85.8 t -56.5 -34.04 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 O-C-N 121.093 -1.004 . . . . 0.0 110.253 179.75 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.8 tttp -52.85 -40.95 63.82 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.855 -1.153 . . . . 0.0 110.029 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -59.33 -29.6 67.76 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.261 178.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -68.05 -51.55 45.4 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.94 -1.1 . . . . 0.0 110.327 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.0 p90 -100.16 35.62 2.04 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.068 -1.02 . . . . 0.0 111.157 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -87.95 -37.91 16.01 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.863 -1.148 . . . . 0.0 110.001 178.694 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -110.79 29.63 7.57 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.273 -0.892 . . . . 0.0 110.865 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.418 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 26.5 t90 -93.98 -42.74 8.89 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.02 -1.05 . . . . 0.0 110.01 179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.418 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -145.59 -60.28 0.34 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.206 -0.934 . . . . 0.0 110.382 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -146.08 -171.17 3.66 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.128 -0.983 . . . . 0.0 110.266 -179.919 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -106.59 39.57 1.81 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.122 -0.986 . . . . 0.0 110.137 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -150.75 76.14 1.24 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.259 -0.9 . . . . 0.0 110.405 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.15 73.66 1.43 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.17 -0.956 . . . . 0.0 110.297 -179.902 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.22 35.49 4.63 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.597 179.673 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 5.5 p -110.58 -54.18 2.61 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.068 -1.02 . . . . 0.0 109.463 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -61.47 -20.9 63.66 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.183 -0.948 . . . . 0.0 111.377 179.28 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.3 mm -71.56 -42.64 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 120.719 -1.238 . . . . 0.0 109.509 179.685 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.22 -39.57 92.95 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.161 -0.962 . . . . 0.0 110.053 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -64.36 -34.83 79.07 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.08 -1.013 . . . . 0.0 110.626 -179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m . . . . . 0 N--CA 1.505 2.28 0 O-C-N 120.993 -1.067 . . . . 0.0 110.447 179.975 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt . . . . . 0 N--CA 1.505 2.309 0 CA-C-O 121.04 0.447 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.402 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 39.3 t80 -112.26 151.9 29.1 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.041 -1.037 . . . . 0.0 110.19 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -125.93 137.18 53.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.19 -0.944 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 36.2 t -114.77 92.37 3.92 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.213 -0.929 . . . . 0.0 110.061 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -51.45 -35.94 41.87 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.093 -1.004 . . . . 0.0 110.361 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CE2' HG12 ' A' ' 34' ' ' VAL . 90.9 m-85 -60.0 -31.08 69.59 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.138 -0.976 . . . . 0.0 110.008 178.882 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 m -98.9 0.84 44.96 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.002 -1.061 . . . . 0.0 112.237 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.1 38.34 23.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.315 -1.491 . . . . 0.0 110.679 -179.662 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -146.61 171.68 14.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.401 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER -125.94 126.5 44.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.251 -179.73 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -77.32 167.43 21.72 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.173 -0.955 . . . . 0.0 109.885 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.1 t -100.15 -30.49 11.9 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.137 -0.977 . . . . 0.0 111.635 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -110.4 144.63 38.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.772 -1.205 . . . . 0.0 110.32 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -121.87 95.31 4.61 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.418 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.77 177.93 1.67 Allowed Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.192 -0.943 . . . . 0.0 110.158 -179.578 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.418 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.2 Cg_endo -71.16 -32.41 13.09 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.396 1.209 . . . . 0.0 110.916 179.859 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.403 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.8 t -87.4 -40.02 14.75 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.974 -1.079 . . . . 0.0 110.0 179.588 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -61.11 -45.62 98.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.131 -0.981 . . . . 0.0 109.612 179.724 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 46.8 mtt180 -60.0 -53.79 53.71 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.096 -1.002 . . . . 0.0 109.483 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -59.79 -39.51 85.2 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.142 -0.974 . . . . 0.0 109.026 178.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 19' ' ' SER . 96.7 m -55.31 -42.79 74.19 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.075 -1.016 . . . . 0.0 108.517 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -63.12 -37.05 85.67 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.153 178.116 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 49.01 1.02 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.116 -0.99 . . . . 0.0 110.509 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 m -115.51 38.6 3.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.104 -0.997 . . . . 0.0 110.182 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.2 126.03 2.4 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.8 ttm-85 -53.31 -29.18 32.28 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.115 -1.226 . . . . 0.0 110.398 179.046 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 -33.92 70.14 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.042 -1.036 . . . . 0.0 110.654 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -51.34 -38.92 55.67 Favored 'General case' 0 N--CA 1.516 2.84 0 O-C-N 120.908 -1.12 . . . . 0.0 110.603 -179.591 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -62.99 -53.85 47.53 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.089 179.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.49 -39.26 87.05 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.22 -0.925 . . . . 0.0 108.956 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.52 -39.07 70.06 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.212 -0.93 . . . . 0.0 110.083 179.208 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.434 HG12 ' CE2' ' A' ' 8' ' ' TYR . 76.4 t -60.17 -36.44 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.071 -1.018 . . . . 0.0 109.761 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 61.2 tttp -52.75 -40.35 63.01 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.974 -1.078 . . . . 0.0 109.993 179.565 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.87 -33.44 68.7 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 179.12 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -63.94 -52.63 58.88 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.082 -1.011 . . . . 0.0 109.961 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 48.8 p90 -100.34 33.72 2.59 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.142 -0.973 . . . . 0.0 111.109 179.631 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -81.39 -38.81 25.96 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.781 -1.199 . . . . 0.0 110.181 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -117.08 21.21 13.37 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.244 -0.91 . . . . 0.0 111.636 179.791 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 17.6 t90 -59.85 -40.0 87.09 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.827 -1.171 . . . . 0.0 110.038 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.464 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 4.6 mtm -149.9 37.99 0.73 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -0.968 . . . . 0.0 110.59 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.16 38.18 20.32 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.0 -1.063 . . . . 0.0 110.975 179.924 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -145.99 -172.98 4.04 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.252 -0.905 . . . . 0.0 110.418 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -113.58 125.12 53.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 110.121 179.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -124.29 76.17 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.208 -0.932 . . . . 0.0 110.311 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -106.74 36.15 2.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.178 -0.951 . . . . 0.0 110.379 179.479 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -113.12 -54.9 2.58 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.214 -0.928 . . . . 0.0 109.571 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -22.01 61.55 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.186 -0.946 . . . . 0.0 111.463 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.426 HG21 HD11 ' A' ' 50' ' ' ILE . 45.9 mm -68.34 -47.13 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 120.606 -1.309 . . . . 0.0 109.371 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -57.54 -36.7 71.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.155 -0.966 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -77.18 -34.81 56.24 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.016 -1.053 . . . . 0.0 110.643 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.4 m . . . . . 0 N--CA 1.506 2.368 0 O-C-N 121.034 -1.041 . . . . 0.0 110.26 179.977 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 mttp . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -109.62 161.86 14.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.219 -0.926 . . . . 0.0 110.118 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -136.51 135.33 38.44 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.141 -0.974 . . . . 0.0 110.24 -179.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -116.84 92.72 3.94 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.146 -0.971 . . . . 0.0 110.001 179.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -51.78 -35.77 45.05 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.014 -1.054 . . . . 0.0 110.408 179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE1' HG12 ' A' ' 34' ' ' VAL . 92.5 m-85 -60.04 -32.95 71.39 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.133 -0.979 . . . . 0.0 110.004 179.008 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 m -95.54 -2.83 47.71 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.051 -1.031 . . . . 0.0 112.254 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.23 39.71 30.12 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.324 -1.485 . . . . 0.0 110.399 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -145.66 171.4 14.77 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.359 -0.838 . . . . 0.0 110.191 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -118.41 140.37 49.96 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.246 -0.909 . . . . 0.0 110.565 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -96.72 167.19 11.27 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.204 -0.935 . . . . 0.0 109.623 179.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.416 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -100.05 -29.81 12.32 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.847 -179.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.416 ' CD2' HG21 ' A' ' 14' ' ' THR . 51.3 m-70 -113.0 147.58 36.87 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.742 -1.223 . . . . 0.0 110.379 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -126.55 93.93 3.92 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.238 -0.914 . . . . 0.0 109.789 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.61 177.83 1.64 Allowed Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.194 -0.941 . . . . 0.0 110.277 -179.598 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.95 -27.66 25.31 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.383 1.202 . . . . 0.0 111.154 179.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.75 -39.0 12.04 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.92 -1.113 . . . . 0.0 110.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.93 -49.26 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.001 -1.062 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -57.55 -48.43 79.33 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.141 -0.975 . . . . 0.0 109.635 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.0 -41.26 97.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.196 -0.94 . . . . 0.0 108.725 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.4 m -54.21 -43.22 70.61 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.18 -0.95 . . . . 0.0 108.439 178.336 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -63.19 -39.39 94.52 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 119.636 -0.826 . . . . 0.0 108.871 177.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -95.3 53.61 1.53 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.223 -0.923 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.55 37.83 3.79 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.094 -1.004 . . . . 0.0 110.33 179.859 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.79 126.62 2.31 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -28.54 46.48 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.129 -1.218 . . . . 0.0 110.102 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -57.14 -33.05 67.0 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.002 -1.061 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -49.36 -37.87 26.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.99 -1.069 . . . . 0.0 110.915 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -59.65 -56.38 22.58 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.096 -1.002 . . . . 0.0 109.479 179.465 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.25 -38.89 81.15 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.227 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.54 -36.69 69.53 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.106 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE1' ' A' ' 8' ' ' TYR . 50.3 t -55.65 -35.46 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.056 -1.028 . . . . 0.0 110.31 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.5 mtpt -52.93 -40.38 63.56 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.879 -1.138 . . . . 0.0 110.115 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.97 -29.95 63.67 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 179.11 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.61 -53.31 23.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.907 -1.121 . . . . 0.0 110.094 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 41.1 p90 -100.2 36.01 1.96 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.117 -0.99 . . . . 0.0 111.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.71 -36.76 23.46 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.705 -1.247 . . . . 0.0 110.359 179.144 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mttp -104.8 23.63 13.15 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.217 -0.927 . . . . 0.0 111.229 179.564 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.474 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.3 t90 -105.19 -49.87 3.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.886 -1.134 . . . . 0.0 110.414 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.474 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -104.94 -47.97 3.87 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.142 -0.974 . . . . 0.0 110.38 179.939 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 54.62 38.62 30.25 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.917 -1.114 . . . . 0.0 110.628 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -151.77 -65.94 0.18 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.21 -0.931 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.35 82.41 0.41 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.165 -0.959 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.64 73.04 1.5 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.372 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -121.12 33.67 5.47 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.157 -0.964 . . . . 0.0 110.609 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -50.44 3.04 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.027 -1.046 . . . . 0.0 109.825 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -21.08 63.5 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.179 -0.95 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.422 HD13 ' CE1' ' A' ' 38' ' ' TYR . 48.6 mm -74.36 -38.73 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 O-C-N 120.673 -1.267 . . . . 0.0 109.944 179.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -83.55 -39.21 20.69 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.121 -0.987 . . . . 0.0 110.079 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -37.89 89.06 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.132 -0.98 . . . . 0.0 110.007 179.596 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.0 m . . . . . 0 N--CA 1.507 2.414 0 O-C-N 121.079 -1.013 . . . . 0.0 110.287 179.756 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.444 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 53.8 mttp . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.418 ' CE1' ' HD3' ' A' ' 21' ' ' ARG . 67.5 t80 -110.14 161.73 15.28 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.226 -0.921 . . . . 0.0 110.06 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -125.44 133.91 52.29 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.25 99.75 7.84 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.068 -1.02 . . . . 0.0 110.003 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -52.74 -36.02 56.99 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 120.977 -1.077 . . . . 0.0 110.548 179.942 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.417 ' CE1' HG12 ' A' ' 34' ' ' VAL . 94.9 m-85 -62.8 -30.43 71.46 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.097 -1.002 . . . . 0.0 110.267 179.243 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 50.0 m -99.84 -12.04 20.23 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.981 -1.074 . . . . 0.0 111.979 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.5 t70 57.14 41.88 26.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.405 -1.434 . . . . 0.0 109.972 -179.42 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -143.73 174.23 10.98 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 5.7 t80 -115.8 112.72 22.4 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.274 -0.892 . . . . 0.0 110.46 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.416 HD23 ' CG ' ' A' ' 24' ' ' HIS . 3.6 mp -65.91 171.27 4.57 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.233 -0.917 . . . . 0.0 109.713 179.688 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.416 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.5 t -97.34 -30.1 13.14 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.235 -0.916 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.416 ' CD2' HG21 ' A' ' 14' ' ' THR . 44.8 m-70 -115.45 148.87 38.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.952 -1.092 . . . . 0.0 110.34 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -126.45 93.97 3.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 109.692 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -147.24 178.87 1.3 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.201 -0.937 . . . . 0.0 110.082 -179.641 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.58 -31.18 13.89 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.326 1.172 . . . . 0.0 110.971 179.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 t -88.13 -38.78 15.08 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.958 -1.089 . . . . 0.0 110.029 179.443 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.89 -45.84 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 121.081 -1.012 . . . . 0.0 109.416 179.568 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.418 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 24.5 mtt180 -59.35 -52.24 66.48 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.464 179.768 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -41.02 97.9 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.858 178.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -56.19 -43.22 78.25 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.098 -1.001 . . . . 0.0 108.564 178.249 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.416 ' CG ' HD23 ' A' ' 13' ' ' LEU . 64.8 t60 -61.71 -34.56 76.01 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.27 178.086 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -100.47 40.35 1.27 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.071 -1.018 . . . . 0.0 110.633 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 28.8 m -116.27 38.5 3.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.171 -0.956 . . . . 0.0 110.003 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.65 129.93 4.53 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -54.57 -28.56 46.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.189 -1.183 . . . . 0.0 110.403 179.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -60.07 -36.85 78.27 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.964 -1.085 . . . . 0.0 110.475 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -51.38 -36.37 43.02 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 120.942 -1.099 . . . . 0.0 110.632 -179.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -55.57 -52.03 65.1 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.0 -1.063 . . . . 0.0 109.768 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -61.11 -40.53 94.09 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.405 -0.918 . . . . 0.0 108.996 178.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -56.56 -37.07 70.03 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.252 -0.905 . . . . 0.0 110.3 179.171 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.417 HG12 ' CE1' ' A' ' 8' ' ' TYR . 97.6 t -64.94 -37.02 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.083 -1.011 . . . . 0.0 110.048 179.8 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.1 tppt? -53.71 -42.43 68.04 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 120.83 -1.169 . . . . 0.0 109.925 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.66 -28.04 65.34 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.424 179.067 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -72.86 -51.54 18.33 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.893 -1.129 . . . . 0.0 110.528 -179.752 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.2 p90 -99.63 35.4 2.0 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.03 -1.044 . . . . 0.0 111.415 179.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.68 -39.11 15.27 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.828 -1.17 . . . . 0.0 109.98 178.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -116.72 34.22 5.18 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.252 -0.905 . . . . 0.0 110.599 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.4 t90 -91.51 -39.03 12.16 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.175 -0.953 . . . . 0.0 110.282 -179.853 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 mtm -154.32 -67.24 0.14 Allowed 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.121 -0.987 . . . . 0.0 110.579 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -135.05 -171.82 2.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.192 -0.943 . . . . 0.0 110.126 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -110.12 39.42 2.16 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.0 110.154 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -146.7 74.33 1.35 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.162 -0.961 . . . . 0.0 110.266 179.876 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.41 73.35 1.37 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.95 35.06 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.113 -0.992 . . . . 0.0 110.502 179.58 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 59.9 p -109.71 -53.48 2.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.149 -0.969 . . . . 0.0 109.473 179.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -20.96 63.48 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.216 -0.928 . . . . 0.0 111.339 179.205 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.441 HD11 HG22 ' A' ' 50' ' ' ILE . 49.0 mm -74.33 -47.21 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.66 -1.275 . . . . 0.0 109.701 179.628 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -58.27 -40.03 80.81 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.214 -0.928 . . . . 0.0 110.068 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.1 mttm -57.41 -35.91 70.65 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.577 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.4 m . . . . . 0 N--CA 1.504 2.232 0 O-C-N 120.965 -1.084 . . . . 0.0 110.394 179.921 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -115.23 159.47 20.93 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.191 -0.943 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -136.61 139.48 42.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.099 -1.001 . . . . 0.0 110.7 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.1 t -112.23 96.98 6.33 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.896 . . . . 0.0 110.105 179.519 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -54.8 -36.43 64.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.056 -1.028 . . . . 0.0 110.339 179.865 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 90.0 m-85 -60.44 -32.08 71.02 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.117 -0.989 . . . . 0.0 110.049 179.23 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.7 m -96.91 -2.74 43.16 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.957 -1.089 . . . . 0.0 112.14 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 53.77 38.69 29.08 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.397 -1.44 . . . . 0.0 110.475 -179.545 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -140.1 174.85 10.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -0.912 . . . . 0.0 109.899 179.894 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.79 121.77 38.9 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.268 -0.895 . . . . 0.0 110.258 -179.633 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -80.52 166.51 21.11 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.043 -1.036 . . . . 0.0 109.544 179.371 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.42 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -100.89 -29.5 12.19 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.125 -0.984 . . . . 0.0 111.891 -179.535 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.42 ' CD2' HG21 ' A' ' 14' ' ' THR . 53.0 m-70 -112.23 146.79 37.52 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.824 -1.173 . . . . 0.0 110.276 -179.821 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -125.13 93.51 3.9 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 109.849 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.21 178.68 1.36 Allowed Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.39 -31.27 14.26 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.267 1.14 . . . . 0.0 110.87 179.888 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.4 ' O ' ' OG1' ' A' ' 23' ' ' THR . 2.8 t -87.16 -40.15 14.86 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.937 -1.102 . . . . 0.0 109.979 179.591 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.3 t -61.57 -49.03 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 121.183 -0.948 . . . . 0.0 109.476 179.655 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.6 mtp-105 -58.39 -50.76 72.51 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.53 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -62.08 -41.16 97.9 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.111 -0.993 . . . . 0.0 108.803 178.803 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.4 m -55.67 -43.38 76.3 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.13 -0.981 . . . . 0.0 108.451 178.376 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -62.33 -38.76 90.72 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.404 -0.81 . . . . 0.0 108.922 178.02 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -92.7 55.86 2.53 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.227 -0.921 . . . . 0.0 110.31 -179.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.98 37.4 4.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.055 -1.028 . . . . 0.0 110.326 179.789 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.28 128.64 3.46 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.0 ttp-105 -54.64 -28.12 44.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.171 -1.193 . . . . 0.0 110.639 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -62.47 -34.1 76.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.929 -1.107 . . . . 0.0 110.574 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -51.58 -41.78 61.43 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.946 -1.096 . . . . 0.0 110.583 -179.595 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -62.54 -54.65 36.7 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.091 179.31 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -39.15 83.9 Favored 'General case' 0 N--CA 1.508 2.471 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.117 178.572 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -55.94 -38.18 69.97 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.227 -0.92 . . . . 0.0 110.069 179.172 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 95.2 t -65.95 -34.51 70.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.148 -0.97 . . . . 0.0 110.025 179.61 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 25.4 tttt -52.14 -39.92 60.64 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.909 -1.119 . . . . 0.0 109.983 179.431 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -59.07 -29.49 67.37 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 178.903 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -71.72 -53.09 14.6 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.862 -1.149 . . . . 0.0 110.278 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 37.0 p90 -99.27 32.0 2.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.068 -1.02 . . . . 0.0 111.448 179.852 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.47 -38.94 54.59 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.728 -1.232 . . . . 0.0 110.138 179.166 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.11 31.28 5.83 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.212 -0.93 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.8 t90 -108.51 -57.42 2.13 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.073 -1.017 . . . . 0.0 110.404 -179.758 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.45 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 0.5 OUTLIER -123.11 54.05 1.27 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.232 -0.918 . . . . 0.0 110.015 -179.989 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 -171.36 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.022 -1.049 . . . . 0.0 110.581 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -82.29 -172.86 4.23 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.163 -0.961 . . . . 0.0 110.0 179.987 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 54.76 73.89 0.38 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.015 -1.053 . . . . 0.0 110.493 -179.801 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.403 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -148.97 69.99 1.09 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.202 -0.936 . . . . 0.0 110.413 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -114.0 33.94 4.94 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.274 -0.891 . . . . 0.0 110.589 179.62 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -105.9 -51.6 2.96 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.053 -1.03 . . . . 0.0 109.309 179.198 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.4 -21.65 62.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.239 -0.913 . . . . 0.0 111.355 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.1 mm -79.27 -46.31 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.595 -1.316 . . . . 0.0 109.741 179.633 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.72 -37.62 82.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -75.74 -35.53 60.18 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.148 -0.97 . . . . 0.0 110.584 179.946 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.506 2.335 0 O-C-N 121.08 -1.012 . . . . 0.0 110.071 179.852 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.422 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 26.3 mttt . . . . . 0 N--CA 1.501 2.123 0 CA-C-O 120.858 0.361 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.65 156.73 3.35 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.089 -1.007 . . . . 0.0 110.937 -179.553 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -137.75 129.75 28.82 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.36 -0.838 . . . . 0.0 109.145 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.2 t -109.99 92.69 4.15 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.024 -1.047 . . . . 0.0 110.523 179.89 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.13 -35.35 59.59 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.059 -1.026 . . . . 0.0 110.201 179.327 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.442 ' CE1' HG12 ' A' ' 34' ' ' VAL . 84.0 m-85 -60.44 -34.43 73.97 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.109 -0.995 . . . . 0.0 109.941 179.14 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.8 m -96.27 -0.29 49.9 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.089 -1.007 . . . . 0.0 112.136 -179.922 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.55 38.57 26.07 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.365 -1.459 . . . . 0.0 110.678 -179.755 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -139.56 166.97 23.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.979 . . . . 0.0 110.042 179.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 22.4 t80 -120.35 127.11 52.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.211 -0.931 . . . . 0.0 110.22 -179.712 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.86 167.58 15.87 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.527 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -99.47 -31.62 11.55 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.114 -0.991 . . . . 0.0 111.708 -179.34 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.415 ' CD2' HG21 ' A' ' 14' ' ' THR . 36.9 m-70 -117.72 139.43 51.05 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.899 -1.126 . . . . 0.0 110.278 -179.872 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -114.66 94.18 4.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.215 -0.928 . . . . 0.0 109.821 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -139.21 178.72 1.52 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.292 -0.88 . . . . 0.0 110.072 -179.653 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.76 -32.2 14.81 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.351 1.185 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.42 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.4 OUTLIER -86.72 -44.4 11.83 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.966 -1.084 . . . . 0.0 109.737 179.44 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.2 t -60.43 -51.35 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 121.17 -0.956 . . . . 0.0 109.552 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -58.49 -50.47 73.62 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.084 -1.01 . . . . 0.0 109.393 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -61.32 -40.12 93.05 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.874 178.77 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 19' ' ' SER . 68.9 m -54.07 -42.87 69.78 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.105 -0.997 . . . . 0.0 108.562 178.262 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -63.06 -39.85 95.93 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.361 -0.837 . . . . 0.0 108.898 178.135 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.81 56.64 2.35 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.32 -0.862 . . . . 0.0 110.089 -179.912 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.95 37.74 3.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.154 -0.966 . . . . 0.0 110.362 179.892 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -149.51 124.59 1.82 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.991 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -28.31 39.13 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.075 -1.25 . . . . 0.0 110.4 178.946 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -60.07 -31.34 69.92 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.948 -1.095 . . . . 0.0 110.691 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -49.04 -38.1 22.87 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.91 -1.119 . . . . 0.0 110.986 -179.499 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.21 -54.66 29.96 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.014 179.284 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -60.91 -39.28 88.75 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.034 178.703 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -55.94 -37.04 68.44 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.191 -0.943 . . . . 0.0 110.075 179.15 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.442 HG12 ' CE1' ' A' ' 8' ' ' TYR . 50.1 t -55.22 -36.44 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.635 0 O-C-N 121.033 -1.042 . . . . 0.0 110.035 179.769 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.4 tttt -57.6 -42.24 82.84 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 120.969 -1.082 . . . . 0.0 109.481 179.309 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -59.18 -26.86 65.17 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.305 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -70.12 -52.52 23.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.893 -1.129 . . . . 0.0 110.406 -179.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 32.8 p90 -97.45 20.94 10.85 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.036 -1.04 . . . . 0.0 111.947 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -61.48 -40.0 92.97 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.6 -1.312 . . . . 0.0 109.848 179.192 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.22 31.38 6.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.23 -0.919 . . . . 0.0 110.875 179.723 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.417 ' CE2' ' HE3' ' A' ' 42' ' ' MET . 24.2 t90 -77.29 -59.17 2.89 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.133 -0.979 . . . . 0.0 110.316 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.417 ' HE3' ' CE2' ' A' ' 41' ' ' TRP . 7.1 tpp -137.52 -59.55 0.67 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.121 -0.987 . . . . 0.0 110.539 -179.788 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -114.86 -173.54 2.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.162 -0.961 . . . . 0.0 110.411 -179.797 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -97.49 -35.78 10.54 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.27 -0.894 . . . . 0.0 110.849 -179.946 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -106.13 83.79 1.95 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.93 -1.106 . . . . 0.0 110.399 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.408 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -115.47 70.41 0.75 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.247 -0.908 . . . . 0.0 109.873 179.715 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.66 34.86 4.53 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.199 -0.938 . . . . 0.0 110.54 179.847 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 t -107.49 -53.78 2.57 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.087 -1.008 . . . . 0.0 109.213 179.118 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.17 -20.7 64.41 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.307 -0.87 . . . . 0.0 111.31 179.109 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.4 mm -77.58 -40.64 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 120.731 -1.231 . . . . 0.0 109.894 179.797 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -58.53 -38.65 78.22 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.175 -0.953 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -73.46 -37.35 65.83 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.157 -0.964 . . . . 0.0 110.202 179.772 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.506 2.363 0 O-C-N 121.045 -1.035 . . . . 0.0 110.366 179.742 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 mtmm . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.411 ' CE1' ' HD3' ' A' ' 21' ' ' ARG . 64.6 t80 -111.28 157.86 19.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.158 -0.964 . . . . 0.0 110.141 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -125.95 135.72 52.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.164 -0.96 . . . . 0.0 110.62 -179.755 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.3 t -113.34 95.0 5.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.188 -0.945 . . . . 0.0 110.019 179.495 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -53.03 -36.08 60.15 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.062 -1.024 . . . . 0.0 110.478 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CE2' HG12 ' A' ' 34' ' ' VAL . 83.0 m-85 -60.19 -32.96 71.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.088 -1.007 . . . . 0.0 109.927 179.108 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m -95.47 -0.08 52.7 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.011 -1.056 . . . . 0.0 112.061 179.927 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.95 38.57 24.06 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.435 -1.416 . . . . 0.0 110.635 -179.783 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -148.9 171.15 16.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.291 -0.881 . . . . 0.0 110.149 179.933 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -117.36 124.94 50.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.198 -0.939 . . . . 0.0 110.238 -179.664 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.2 170.16 16.11 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.132 -0.98 . . . . 0.0 109.784 179.646 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -101.02 -21.36 15.05 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.236 -0.915 . . . . 0.0 112.176 -179.712 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -119.4 147.28 44.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.53 -1.356 . . . . 0.0 110.291 179.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -124.47 94.84 4.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.22 -0.925 . . . . 0.0 109.961 179.813 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.67 177.4 1.79 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.187 -0.946 . . . . 0.0 110.413 -179.625 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.86 -32.71 13.58 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.41 1.216 . . . . 0.0 110.845 179.849 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.405 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.4 m -87.26 -38.95 15.84 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.043 -1.036 . . . . 0.0 110.027 179.552 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.38 -49.31 84.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 179.645 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 19.9 mtt180 -58.26 -50.81 72.29 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.079 -1.013 . . . . 0.0 109.605 179.648 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.57 -41.33 98.87 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.346 -0.941 . . . . 0.0 108.748 178.825 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.5 m -55.96 -43.29 77.36 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.221 -0.924 . . . . 0.0 108.625 178.416 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -61.79 -36.25 80.55 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.701 -0.8 . . . . 0.0 109.199 178.218 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.14 52.31 1.28 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.135 -0.978 . . . . 0.0 110.274 -179.813 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -116.49 37.98 3.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.244 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.12 127.1 2.77 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 -179.981 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.7 ttt-85 -54.93 -28.05 47.98 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.097 -1.237 . . . . 0.0 110.342 179.179 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -60.05 -34.45 73.42 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.957 -1.09 . . . . 0.0 110.507 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -51.09 -39.1 55.31 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.948 -1.095 . . . . 0.0 110.537 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -63.19 -55.37 25.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.101 -1.0 . . . . 0.0 109.084 179.328 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.95 -39.23 84.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.23 -0.919 . . . . 0.0 109.199 178.701 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -56.94 -38.18 72.56 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.217 -0.927 . . . . 0.0 110.036 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG12 ' CE2' ' A' ' 8' ' ' TYR . 90.0 t -58.19 -35.21 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.154 -0.966 . . . . 0.0 110.067 179.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.9 ttmt -52.27 -40.52 61.87 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.969 -1.082 . . . . 0.0 109.952 179.535 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -58.13 -29.95 65.95 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.577 -0.849 . . . . 0.0 110.298 178.96 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -69.2 -52.8 24.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.877 -1.14 . . . . 0.0 110.042 179.909 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.7 p90 -100.35 35.83 2.02 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.138 -0.976 . . . . 0.0 111.083 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -38.08 16.32 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.799 -1.188 . . . . 0.0 110.044 178.921 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -107.47 26.75 9.85 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.1 t90 -106.74 -55.99 2.25 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.966 -1.084 . . . . 0.0 109.893 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 1.3 mtm -128.64 55.43 1.7 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.252 -0.905 . . . . 0.0 109.713 179.711 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 55.8 -163.48 0.15 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.933 -1.104 . . . . 0.0 110.337 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -99.74 48.94 0.93 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.13 -0.981 . . . . 0.0 110.221 179.92 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -140.11 73.06 1.41 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.212 -0.93 . . . . 0.0 109.959 179.736 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.79 73.4 0.62 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.272 -0.892 . . . . 0.0 110.793 -179.823 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -112.51 35.3 3.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.16 -0.962 . . . . 0.0 110.434 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -109.06 -52.72 2.73 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.112 -0.992 . . . . 0.0 109.586 179.289 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.47 -20.93 63.7 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.232 -0.918 . . . . 0.0 111.464 179.335 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 48.7 mm -74.67 -45.95 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 120.747 -1.221 . . . . 0.0 109.835 179.842 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -65.4 -40.7 93.76 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.229 -0.919 . . . . 0.0 110.067 -179.938 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -58.32 -36.75 73.85 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.147 -0.971 . . . . 0.0 110.532 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.504 2.251 0 O-C-N 121.018 -1.052 . . . . 0.0 110.422 179.91 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -111.46 160.87 16.71 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.19 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -143.68 131.15 21.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.161 -0.962 . . . . 0.0 110.375 -179.48 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.0 t -109.93 87.1 2.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.154 -0.967 . . . . 0.0 109.684 179.13 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -50.37 -35.71 29.24 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.11 -0.994 . . . . 0.0 110.937 -179.562 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.447 ' CZ ' ' CD1' ' A' ' 50' ' ' ILE . 25.5 m-85 -61.82 -30.64 70.96 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.084 -1.01 . . . . 0.0 109.919 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.1 m -98.48 0.52 45.3 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.943 -1.098 . . . . 0.0 112.058 179.674 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 52.89 38.08 25.96 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.395 -1.44 . . . . 0.0 110.839 -179.881 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -139.4 168.93 18.71 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.191 -0.943 . . . . 0.0 109.999 179.571 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -121.83 140.27 52.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.175 -0.953 . . . . 0.0 110.886 -179.69 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -106.44 152.63 23.38 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.247 -0.908 . . . . 0.0 109.39 179.302 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 t -99.1 -30.71 12.15 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.113 -0.992 . . . . 0.0 111.693 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -111.46 125.3 53.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.823 -1.173 . . . . 0.0 110.189 179.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -110.2 88.53 2.78 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.114 -0.991 . . . . 0.0 109.742 179.679 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -133.24 -179.78 1.17 Allowed Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 109.81 -179.602 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -71.05 -26.97 20.97 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.271 1.142 . . . . 0.0 111.238 179.885 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.418 ' O ' ' OG1' ' A' ' 23' ' ' THR . 68.0 m -90.17 -40.22 12.35 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.742 -1.224 . . . . 0.0 110.053 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.6 t -69.04 -48.35 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.06 -1.025 . . . . 0.0 109.699 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -59.06 -51.42 70.1 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.079 -1.013 . . . . 0.0 109.467 179.77 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -59.32 -40.2 85.5 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.163 -0.961 . . . . 0.0 108.891 178.862 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 19' ' ' SER . 49.7 m -54.67 -43.02 72.06 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.07 -1.019 . . . . 0.0 108.303 178.301 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -66.09 -40.93 91.19 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.739 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.66 57.15 2.49 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.322 -0.861 . . . . 0.0 110.093 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -113.34 37.97 3.03 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.047 -1.033 . . . . 0.0 110.453 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.12 124.49 1.61 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -53.76 -28.72 36.31 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.157 -1.202 . . . . 0.0 110.27 179.068 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -59.33 -31.24 68.99 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 110.701 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.2 t-80 -48.85 -48.05 42.25 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.927 -1.108 . . . . 0.0 111.175 -179.382 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -58.86 -53.33 59.57 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.053 -1.029 . . . . 0.0 109.37 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.44 -38.98 85.86 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.163 -0.961 . . . . 0.0 109.036 178.556 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -56.46 -38.98 72.4 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.24 -0.912 . . . . 0.0 110.027 179.249 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' CD2' ' A' ' 8' ' ' TYR . 97.3 t -60.17 -38.03 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.092 -1.005 . . . . 0.0 109.76 179.747 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 27.3 ttmt -53.65 -39.73 65.28 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.961 -1.087 . . . . 0.0 109.97 179.441 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -58.63 -34.74 71.51 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.209 -0.932 . . . . 0.0 109.997 179.162 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -64.27 -52.47 58.49 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.036 -1.04 . . . . 0.0 109.931 179.867 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.438 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.6 35.43 2.15 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.118 -0.989 . . . . 0.0 110.991 179.491 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -84.61 -37.71 20.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.8 -1.187 . . . . 0.0 110.267 179.138 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -111.5 21.82 15.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.132 -0.98 . . . . 0.0 111.482 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.7 t90 -60.44 -46.91 88.35 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.861 -1.149 . . . . 0.0 109.963 179.949 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.5 mtm -151.68 36.74 0.57 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.155 -0.965 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 50.9 41.63 27.13 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.011 -1.055 . . . . 0.0 110.899 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.4 -168.03 2.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.162 -0.961 . . . . 0.0 110.318 -179.931 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -117.96 124.86 49.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.406 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -125.78 76.7 1.6 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.241 -0.912 . . . . 0.0 110.259 -179.898 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.81 35.71 3.26 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.201 -0.937 . . . . 0.0 110.57 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.3 t -112.77 -55.66 2.5 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.209 -0.932 . . . . 0.0 109.378 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -21.28 64.25 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.225 -0.922 . . . . 0.0 111.064 179.075 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.447 ' CD1' ' CZ ' ' A' ' 8' ' ' TYR . 47.5 mm -69.92 -41.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.608 -1.307 . . . . 0.0 109.306 179.498 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -71.46 -37.04 71.4 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.19 -0.944 . . . . 0.0 110.327 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -80.3 -36.31 34.53 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.106 -0.996 . . . . 0.0 110.367 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.507 2.416 0 O-C-N 121.08 -1.013 . . . . 0.0 110.339 179.972 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.411 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 18.2 mtmt . . . . . 0 N--CA 1.495 1.799 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.415 ' CD2' ' HD3' ' A' ' 21' ' ' ARG . 75.9 t80 -107.74 161.36 14.96 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.132 -0.98 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -133.83 134.25 42.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.251 -0.906 . . . . 0.0 110.157 -179.714 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.8 t -114.59 96.51 5.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.154 -0.966 . . . . 0.0 110.158 179.603 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.56 -35.99 61.36 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.985 -1.072 . . . . 0.0 110.385 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CE2' HG12 ' A' ' 34' ' ' VAL . 92.6 m-85 -61.24 -32.57 72.37 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.033 -1.042 . . . . 0.0 110.132 179.222 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.4 m -97.08 -4.58 39.25 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.954 -1.091 . . . . 0.0 112.163 -179.982 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.47 39.67 30.3 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.371 -1.456 . . . . 0.0 110.442 -179.698 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.98 171.61 13.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.307 -0.871 . . . . 0.0 110.051 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 12.9 t80 -118.45 133.21 56.06 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.254 -0.904 . . . . 0.0 110.328 -179.753 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -89.11 165.65 14.36 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.185 -0.947 . . . . 0.0 109.752 179.588 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 t -98.83 -29.92 12.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.134 -0.979 . . . . 0.0 111.698 -179.567 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -111.05 146.36 36.87 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.877 -1.139 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.11 93.19 3.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.3 178.69 1.37 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.234 -0.916 . . . . 0.0 110.172 -179.594 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.15 -30.72 15.71 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.442 1.233 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -89.73 -40.38 12.55 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.996 -1.065 . . . . 0.0 109.988 179.647 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.3 t -60.06 -50.46 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.641 179.813 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.415 ' HD3' ' CD2' ' A' ' 4' ' ' PHE . 19.7 mtt180 -58.86 -50.75 72.85 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.684 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -61.66 -40.29 94.41 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.17 -0.957 . . . . 0.0 108.832 178.817 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 19' ' ' SER . 85.7 m -54.53 -43.31 71.81 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.1 -1.0 . . . . 0.0 108.358 178.223 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -62.48 -37.78 87.33 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.008 177.814 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.07 48.35 1.0 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.133 -0.98 . . . . 0.0 110.442 -179.82 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.01 38.02 3.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.118 -0.989 . . . . 0.0 110.241 179.757 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.54 128.17 3.28 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.1 ttm105 -54.61 -28.5 47.05 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.144 -1.209 . . . . 0.0 110.361 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -59.15 -35.56 73.71 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.883 -1.135 . . . . 0.0 110.392 179.772 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -51.4 -39.1 56.53 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.023 -1.048 . . . . 0.0 110.5 -179.611 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -62.67 -55.6 25.36 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.136 -0.977 . . . . 0.0 109.128 179.406 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -60.13 -39.25 85.62 Favored 'General case' 0 N--CA 1.509 2.517 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.159 178.807 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -57.36 -37.14 72.15 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.301 -0.875 . . . . 0.0 110.053 179.232 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.424 HG12 ' CE2' ' A' ' 8' ' ' TYR . 73.0 t -56.86 -37.09 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.022 -1.049 . . . . 0.0 110.156 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.8 ttpt -54.13 -40.79 67.71 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.913 -1.117 . . . . 0.0 109.718 179.445 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.95 -28.63 66.46 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.359 178.911 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.74 -53.11 16.79 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.888 -1.132 . . . . 0.0 110.134 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.433 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.7 p90 -99.91 32.66 2.83 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.208 -0.933 . . . . 0.0 111.294 179.625 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -74.17 -35.97 64.05 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.73 -1.231 . . . . 0.0 110.258 179.184 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -107.28 27.0 9.51 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.121 -0.987 . . . . 0.0 111.091 179.61 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.448 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 10.6 t90 -109.45 -55.81 2.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.055 -1.028 . . . . 0.0 110.047 179.922 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.448 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.7 mtm -141.58 57.73 1.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.224 -0.923 . . . . 0.0 109.889 179.67 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -51.18 -36.21 40.0 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.056 -1.027 . . . . 0.0 110.97 -179.711 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -53.36 -58.69 6.22 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.966 -1.084 . . . . 0.0 110.511 -179.852 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.82 87.46 1.92 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.161 -0.962 . . . . 0.0 110.155 179.892 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.49 71.5 1.46 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.156 -0.965 . . . . 0.0 110.546 -179.888 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -144.3 34.89 1.2 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.162 -0.961 . . . . 0.0 110.573 179.426 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -53.42 2.65 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.204 -0.935 . . . . 0.0 109.393 179.192 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.24 65.04 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 111.249 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.1 mm -76.85 -51.97 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 120.647 -1.283 . . . . 0.0 109.787 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.2 -39.66 91.04 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.239 -0.913 . . . . 0.0 110.116 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -57.12 -37.69 72.34 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.072 -1.018 . . . . 0.0 110.507 -179.794 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.9 m . . . . . 0 N--CA 1.503 2.185 0 O-C-N 121.067 -1.021 . . . . 0.0 110.347 179.96 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.7 mttt . . . . . 0 N--CA 1.501 2.109 0 CA-C-O 120.846 0.355 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -123.78 162.38 23.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.15 -0.969 . . . . 0.0 110.308 -179.441 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -138.15 134.19 34.26 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.205 -0.935 . . . . 0.0 110.47 -179.603 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.2 t -112.86 94.2 4.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.215 -0.928 . . . . 0.0 109.975 179.475 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -51.9 -36.05 47.48 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 121.068 -1.02 . . . . 0.0 110.569 179.95 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CE2' HG12 ' A' ' 34' ' ' VAL . 84.0 m-85 -61.2 -32.07 71.83 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.184 -0.947 . . . . 0.0 110.163 179.225 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.9 m -98.74 -4.38 33.62 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.073 -1.017 . . . . 0.0 112.358 -179.864 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.57 38.71 28.81 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.33 -1.481 . . . . 0.0 110.568 -179.642 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -139.61 170.9 15.05 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 109.637 179.785 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -117.77 135.6 53.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.16 -0.963 . . . . 0.0 110.695 -179.592 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -100.82 133.36 45.42 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.174 -0.954 . . . . 0.0 109.483 179.391 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.2 t -75.87 -24.08 55.67 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.187 -0.945 . . . . 0.0 111.881 -179.392 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 46.8 m-70 -110.93 137.8 48.11 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.761 -1.212 . . . . 0.0 110.428 -179.842 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -125.51 85.99 2.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.671 179.659 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.414 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.04 179.69 1.3 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.268 -0.895 . . . . 0.0 109.906 -179.496 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.01 -31.7 14.57 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.329 1.173 . . . . 0.0 110.896 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 69.5 m -86.13 -46.57 10.31 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.876 -1.14 . . . . 0.0 109.752 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.54 -52.72 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.164 -0.96 . . . . 0.0 109.687 179.739 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -56.39 -52.41 64.7 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.025 -1.047 . . . . 0.0 109.634 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -60.62 -39.9 89.89 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.941 178.82 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 87.1 m -55.31 -43.53 74.94 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.044 -1.035 . . . . 0.0 108.313 178.272 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -62.67 -38.87 92.03 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.845 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.15 50.03 1.07 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.318 -0.864 . . . . 0.0 110.399 -179.922 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.33 37.47 3.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -0.987 . . . . 0.0 110.336 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.18 127.16 2.78 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.94 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.27 -28.65 43.24 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.123 -1.222 . . . . 0.0 110.331 179.092 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -59.18 -33.36 70.85 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 120.949 -1.094 . . . . 0.0 110.57 179.735 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -50.58 -39.63 50.13 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.979 -1.076 . . . . 0.0 110.803 -179.545 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -54.77 33.15 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.118 -0.988 . . . . 0.0 109.127 179.368 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.84 -39.16 88.04 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.203 -0.936 . . . . 0.0 109.052 178.693 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -56.27 -37.29 69.6 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.209 -0.932 . . . . 0.0 110.103 179.057 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CE2' ' A' ' 8' ' ' TYR . 77.0 t -55.1 -36.24 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.062 -1.024 . . . . 0.0 110.099 179.609 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 30.9 tttt -54.75 -40.9 69.79 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.928 -1.107 . . . . 0.0 109.714 179.328 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.77 -28.02 65.54 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.372 178.975 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -72.29 -52.79 14.69 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.869 -1.145 . . . . 0.0 110.314 -179.966 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 36.8 p90 -99.28 31.12 3.2 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.11 -0.994 . . . . 0.0 111.5 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.85 -39.53 66.46 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.708 -1.245 . . . . 0.0 110.014 179.251 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -118.81 26.07 9.8 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.265 -0.897 . . . . 0.0 111.235 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 22.8 t90 -69.54 -42.49 74.57 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.962 -1.086 . . . . 0.0 110.078 -179.88 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.445 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.0 ttm -151.09 40.63 0.72 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.166 -0.959 . . . . 0.0 110.532 -179.974 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 52.57 -172.05 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.946 -1.096 . . . . 0.0 110.734 179.869 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 53.56 -172.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.102 -0.999 . . . . 0.0 110.67 -179.957 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -114.24 130.69 56.63 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.231 -0.918 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -120.19 75.29 1.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.291 -0.88 . . . . 0.0 110.114 -179.981 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.54 37.11 2.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.118 -0.989 . . . . 0.0 110.4 179.703 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.1 m -113.91 -55.34 2.51 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.153 -0.967 . . . . 0.0 109.687 179.485 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.03 -21.41 63.58 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.208 -0.933 . . . . 0.0 111.5 179.469 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 44.8 mm -67.21 -41.73 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.568 -1.332 . . . . 0.0 109.424 179.616 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.91 -39.81 95.03 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 179.887 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -66.78 -36.43 82.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.148 -0.97 . . . . 0.0 110.33 179.856 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.7 m . . . . . 0 N--CA 1.504 2.27 0 O-C-N 121.071 -1.018 . . . . 0.0 110.088 179.747 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.1 mtmt . . . . . 0 N--CA 1.493 1.684 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -114.91 162.04 17.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.126 -0.984 . . . . 0.0 110.405 -179.51 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -137.25 133.05 34.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.243 -0.911 . . . . 0.0 110.01 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 t -112.2 93.21 4.34 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.118 179.475 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -52.29 -36.03 51.87 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 121.026 -1.046 . . . . 0.0 110.367 179.813 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE2' HG12 ' A' ' 34' ' ' VAL . 85.4 m-85 -60.28 -30.88 69.74 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.205 -0.935 . . . . 0.0 110.196 178.982 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.1 m -100.81 -2.08 33.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.012 -1.055 . . . . 0.0 112.275 -179.713 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.88 38.34 26.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.407 -1.433 . . . . 0.0 110.664 -179.653 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -140.2 168.45 19.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.213 -0.929 . . . . 0.0 109.762 179.737 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -118.34 142.59 47.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.2 -0.938 . . . . 0.0 110.619 -179.524 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.5 mp -101.37 160.64 14.25 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.211 -0.931 . . . . 0.0 109.769 179.465 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.409 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -102.51 -30.35 11.03 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.191 -0.943 . . . . 0.0 112.045 -179.286 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.409 ' CD2' HG21 ' A' ' 14' ' ' THR . 48.1 m-70 -113.57 111.76 22.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.79 -1.194 . . . . 0.0 110.533 -179.597 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -92.95 67.17 4.3 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.162 -0.961 . . . . 0.0 110.468 179.837 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.415 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -107.39 178.14 1.15 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.155 -0.966 . . . . 0.0 110.009 179.684 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.39 -30.7 15.07 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.332 1.175 . . . . 0.0 111.276 -179.816 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' OG1' ' A' ' 23' ' ' THR . 45.9 m -86.89 -41.13 14.24 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.86 -1.15 . . . . 0.0 110.122 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.7 t -58.45 -57.04 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 O-C-N 121.073 -1.017 . . . . 0.0 109.914 179.893 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -53.69 -50.21 66.35 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.947 -1.095 . . . . 0.0 110.094 -179.824 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -62.97 -41.07 99.44 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.741 178.781 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 19' ' ' SER . 73.6 m -55.05 -43.35 73.72 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.234 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -63.12 -38.49 91.37 Favored 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.832 177.908 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 t -97.6 49.55 1.04 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.366 -179.894 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -117.38 37.79 3.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.06 -1.025 . . . . 0.0 110.375 179.853 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.11 127.27 2.82 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.792 -1.323 . . . . 0.0 109.792 -179.906 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -54.35 -28.59 43.92 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.151 -1.205 . . . . 0.0 110.323 179.064 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -59.36 -33.63 71.4 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.982 -1.073 . . . . 0.0 110.53 179.764 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -50.5 -38.71 45.71 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.98 -1.075 . . . . 0.0 110.793 -179.477 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -62.88 -55.63 24.39 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.165 -0.96 . . . . 0.0 109.153 179.31 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -59.4 -38.56 80.89 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.232 -0.917 . . . . 0.0 109.215 178.661 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.27 -38.26 70.95 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.204 -0.935 . . . . 0.0 110.116 179.327 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE2' ' A' ' 8' ' ' TYR . 75.9 t -58.03 -35.25 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.578 0 O-C-N 121.027 -1.045 . . . . 0.0 110.152 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 22.1 tttt -52.59 -40.58 62.78 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 121.006 -1.059 . . . . 0.0 110.075 179.613 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -57.94 -28.2 64.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.279 -0.888 . . . . 0.0 110.532 178.971 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -71.88 -52.37 17.67 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.856 -1.153 . . . . 0.0 110.386 -179.882 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.8 p90 -99.49 34.1 2.3 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.033 -1.042 . . . . 0.0 111.479 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -80.35 -39.88 27.73 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.758 -1.214 . . . . 0.0 110.074 179.035 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -117.75 34.64 5.05 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.202 -0.936 . . . . 0.0 110.533 179.711 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -92.21 -48.28 6.78 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.122 -0.986 . . . . 0.0 110.539 -179.751 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 tpp -146.02 -60.83 0.32 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.146 -0.971 . . . . 0.0 110.823 -179.785 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -121.8 -175.84 3.19 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.074 -1.016 . . . . 0.0 110.607 -179.603 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -99.89 -37.14 9.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.197 -0.939 . . . . 0.0 110.976 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -104.79 78.83 1.47 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.917 -1.115 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.416 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -116.46 74.76 0.92 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.213 -0.929 . . . . 0.0 110.011 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.9 35.06 3.37 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.206 -0.933 . . . . 0.0 110.673 179.843 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 m -109.8 -54.5 2.55 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.173 -0.954 . . . . 0.0 109.254 179.084 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.72 -20.92 64.02 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.266 -0.896 . . . . 0.0 111.313 179.184 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.412 HG13 ' CE1' ' A' ' 38' ' ' TYR . 47.2 mm -72.72 -40.71 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 120.701 -1.249 . . . . 0.0 109.663 179.703 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 -40.76 62.57 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.196 -0.94 . . . . 0.0 109.911 179.919 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -58.33 -34.41 70.58 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.211 -0.93 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.6 m . . . . . 0 N--CA 1.505 2.293 0 O-C-N 121.014 -1.054 . . . . 0.0 110.263 -179.942 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.7 mttt . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.411 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 85.8 t80 -112.08 161.51 16.42 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.207 -179.931 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -136.72 132.38 34.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.237 -0.914 . . . . 0.0 110.183 -179.573 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.0 t -111.97 94.46 4.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.095 -1.003 . . . . 0.0 110.083 179.526 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.08 -35.82 48.84 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.133 -0.979 . . . . 0.0 110.538 179.901 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CE2' HG12 ' A' ' 34' ' ' VAL . 83.1 m-85 -61.6 -33.36 73.77 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.104 -0.997 . . . . 0.0 110.001 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.3 m -96.12 -3.43 44.58 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.102 -0.999 . . . . 0.0 112.176 179.968 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 52.68 39.33 28.26 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.379 -1.451 . . . . 0.0 110.538 -179.72 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.44 172.72 12.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.942 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -118.89 139.08 52.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.281 -0.887 . . . . 0.0 110.611 -179.62 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -99.08 168.24 10.2 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.209 -0.932 . . . . 0.0 109.626 179.462 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.417 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.79 -30.47 12.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.122 -0.986 . . . . 0.0 111.6 -179.601 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.417 ' CD2' HG21 ' A' ' 14' ' ' THR . 45.2 m-70 -114.85 147.73 39.5 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.892 -1.13 . . . . 0.0 110.214 -179.89 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -126.55 90.6 3.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.197 -0.939 . . . . 0.0 109.801 179.94 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.32 178.32 1.48 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.227 -0.92 . . . . 0.0 110.177 -179.708 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 41.7 Cg_endo -70.12 -31.35 19.08 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.448 1.236 . . . . 0.0 110.802 179.856 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.41 -36.97 23.84 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.056 -1.027 . . . . 0.0 110.057 179.283 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.97 -48.81 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 121.029 -1.044 . . . . 0.0 109.821 179.677 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 21.6 mtm180 -57.27 -52.26 66.06 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.072 -1.018 . . . . 0.0 109.764 179.951 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -59.17 -39.52 82.76 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.13 -0.982 . . . . 0.0 109.203 179.056 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.3 m -55.98 -43.44 77.58 Favored 'General case' 0 N--CA 1.511 2.62 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.237 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -63.04 -40.27 97.21 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.889 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.6 55.83 2.27 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.395 -0.815 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.2 37.34 4.03 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.122 -0.986 . . . . 0.0 110.371 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.6 127.3 2.69 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.932 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -28.11 47.31 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.116 -1.226 . . . . 0.0 110.344 179.138 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -60.3 -33.18 71.99 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.939 -1.101 . . . . 0.0 110.626 179.775 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -49.95 -37.91 34.16 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.955 -1.091 . . . . 0.0 110.781 -179.662 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -62.61 -56.41 18.1 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.086 -1.008 . . . . 0.0 109.166 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.04 -38.59 79.68 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.223 -0.923 . . . . 0.0 109.156 178.764 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -56.59 -37.86 71.21 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 110.035 179.28 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.424 HG12 ' CE2' ' A' ' 8' ' ' TYR . 77.5 t -57.99 -36.34 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.127 -0.983 . . . . 0.0 109.982 179.756 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.7 ttpm? -54.89 -42.29 71.95 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.921 -1.112 . . . . 0.0 109.611 179.488 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.08 -28.33 64.48 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.298 -0.876 . . . . 0.0 110.373 178.899 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -70.23 -52.28 24.35 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.915 -1.116 . . . . 0.0 110.292 -179.841 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.4 p90 -99.77 34.39 2.28 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.096 -1.003 . . . . 0.0 111.358 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.71 -37.28 24.95 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.714 -1.241 . . . . 0.0 110.154 178.83 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -110.32 29.43 7.69 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 179.587 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.1 t90 -90.77 -40.23 11.93 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.014 -1.054 . . . . 0.0 109.973 179.878 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -154.89 -66.46 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.199 -0.938 . . . . 0.0 110.483 179.84 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -124.26 -164.34 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.196 -0.94 . . . . 0.0 110.09 179.971 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -126.9 38.71 4.05 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.104 -0.997 . . . . 0.0 110.378 179.725 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -159.13 75.05 0.67 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.224 -0.922 . . . . 0.0 110.504 179.886 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.17 82.96 1.96 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.137 -0.977 . . . . 0.0 110.349 -179.837 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -109.34 36.08 3.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.119 -0.988 . . . . 0.0 110.33 179.617 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.5 m -115.05 -55.55 2.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.088 -1.007 . . . . 0.0 109.608 179.416 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -22.31 61.97 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.222 -0.924 . . . . 0.0 111.153 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.421 HD11 HG22 ' A' ' 50' ' ' ILE . 45.9 mm -66.39 -39.85 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 120.646 -1.284 . . . . 0.0 109.291 179.191 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -72.35 -36.16 68.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.226 -0.921 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -76.48 -35.6 58.31 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.036 -1.04 . . . . 0.0 110.615 179.93 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m . . . . . 0 N--CA 1.508 2.434 0 O-C-N 121.053 -1.029 . . . . 0.0 110.136 179.944 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.424 ' HB2' ' OH ' ' A' ' 12' ' ' TYR . 32.4 mttm . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 . . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -113.1 161.86 16.61 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.082 -1.011 . . . . 0.0 110.292 -179.626 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -131.59 137.46 48.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.237 -0.914 . . . . 0.0 110.232 -179.82 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.08 97.9 6.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.145 -0.972 . . . . 0.0 109.989 179.512 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -51.93 -35.95 47.48 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.061 -1.025 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.414 ' CE2' HG12 ' A' ' 34' ' ' VAL . 88.8 m-85 -63.19 -32.26 73.61 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.091 -1.006 . . . . 0.0 110.167 179.38 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.8 m -98.2 -8.94 26.47 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.058 -1.026 . . . . 0.0 112.024 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 54.87 41.0 32.25 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.344 -1.472 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.09 173.28 11.66 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.246 -0.909 . . . . 0.0 110.025 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.424 ' OH ' ' HB2' ' A' ' 3' ' ' LYS . 5.1 t80 -120.08 131.52 55.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.577 -179.6 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -88.84 170.45 10.72 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.143 -0.973 . . . . 0.0 109.7 179.48 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.2 t -96.93 -31.29 12.63 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.302 -0.873 . . . . 0.0 111.375 -179.83 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' HG21 ' A' ' 14' ' ' THR . 50.4 m-70 -112.24 146.75 37.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.824 -1.173 . . . . 0.0 110.125 179.916 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -126.27 93.96 3.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 109.861 179.919 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.428 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -148.63 178.47 1.45 Allowed Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.182 -0.949 . . . . 0.0 110.312 -179.533 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.46 -32.87 14.9 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.384 1.202 . . . . 0.0 110.852 179.873 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.406 ' O ' ' OG1' ' A' ' 23' ' ' THR . 29.8 m -83.99 -39.87 19.16 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.965 -1.085 . . . . 0.0 109.839 179.396 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.74 -47.39 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 O-C-N 121.081 -1.012 . . . . 0.0 109.642 179.715 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -57.19 -50.83 71.61 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.127 -0.983 . . . . 0.0 109.565 179.777 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -61.48 -40.96 96.46 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.22 -0.925 . . . . 0.0 108.732 178.803 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.0 m -54.19 -43.22 70.54 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.178 -0.951 . . . . 0.0 108.524 178.33 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -62.33 -37.71 86.67 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.348 -0.845 . . . . 0.0 108.853 178.076 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -96.58 51.66 1.18 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.202 -0.936 . . . . 0.0 110.317 -179.861 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m -117.1 37.64 3.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.28 128.34 3.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.919 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -28.61 45.54 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.136 -1.214 . . . . 0.0 110.351 179.172 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -59.37 -34.9 72.97 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.029 -1.044 . . . . 0.0 110.393 179.764 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.22 -39.01 55.63 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.961 -1.087 . . . . 0.0 110.571 -179.613 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -61.9 -55.09 33.29 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.114 179.27 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -38.84 83.6 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.217 -0.927 . . . . 0.0 109.193 178.65 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.35 -36.96 71.85 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.091 -1.005 . . . . 0.0 110.203 179.156 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.414 HG12 ' CE2' ' A' ' 8' ' ' TYR . 72.2 t -57.85 -35.39 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.08 -1.012 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.8 mmmt -52.65 -39.44 61.81 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.877 -1.14 . . . . 0.0 109.957 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.44 -28.82 65.64 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 178.9 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -73.28 -54.11 9.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.853 -1.154 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 31.6 p90 -98.56 31.73 2.78 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.088 -1.008 . . . . 0.0 111.508 179.88 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.88 -38.41 64.4 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.739 -1.226 . . . . 0.0 109.777 178.948 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.4 22.58 13.95 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.253 -0.904 . . . . 0.0 111.114 179.176 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 17.3 t90 -101.5 -49.31 4.07 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.908 -1.12 . . . . 0.0 109.804 179.662 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.434 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 28.2 mmt -111.98 -53.02 2.75 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.245 -0.91 . . . . 0.0 110.245 179.701 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 54.79 39.31 31.33 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.986 -1.071 . . . . 0.0 110.674 179.99 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -149.04 -66.29 0.23 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.179 -0.95 . . . . 0.0 110.439 179.888 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -166.89 77.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.193 -0.942 . . . . 0.0 110.851 -179.982 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.42 73.4 1.53 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.233 -0.917 . . . . 0.0 110.301 -179.799 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.09 33.62 5.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.162 -0.962 . . . . 0.0 110.524 179.445 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.1 p -107.27 -50.82 3.01 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.096 -1.002 . . . . 0.0 109.678 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.36 -21.84 60.45 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.219 -0.926 . . . . 0.0 111.527 179.369 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.457 HG21 HD11 ' A' ' 50' ' ' ILE . 50.5 mm -76.66 -39.72 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 120.716 -1.24 . . . . 0.0 109.925 179.777 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -80.39 -40.72 25.97 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.153 -0.967 . . . . 0.0 109.958 179.758 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -58.06 -33.24 68.82 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -0.91 . . . . 0.0 110.685 179.816 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.4 m . . . . . 0 N--CA 1.505 2.309 0 O-C-N 120.997 -1.064 . . . . 0.0 110.109 179.945 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.7 mttt . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 120.637 0.256 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -112.69 155.28 24.77 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.213 -0.93 . . . . 0.0 109.816 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -134.28 139.55 45.8 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.158 -0.964 . . . . 0.0 110.532 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.0 t -111.34 98.39 7.45 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.258 -0.901 . . . . 0.0 110.185 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -53.52 -35.79 61.05 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.148 -0.97 . . . . 0.0 110.462 179.72 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE2' HG12 ' A' ' 34' ' ' VAL . 81.1 m-85 -63.01 -33.12 74.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.105 -0.997 . . . . 0.0 110.306 179.44 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.4 m -98.75 -2.83 37.13 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.005 -1.059 . . . . 0.0 112.082 179.855 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 53.8 37.98 27.57 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.37 -1.456 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -131.32 171.66 13.08 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.168 -0.957 . . . . 0.0 109.98 179.697 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -125.06 107.64 11.01 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.905 . . . . 0.0 110.12 179.852 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -67.31 166.74 13.74 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.167 -0.958 . . . . 0.0 109.854 -179.999 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.408 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.19 -30.42 11.93 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.266 -0.896 . . . . 0.0 111.628 -179.694 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.408 ' CD2' HG21 ' A' ' 14' ' ' THR . 42.0 m-70 -115.85 139.76 49.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.819 -1.175 . . . . 0.0 110.184 -179.897 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -116.02 92.04 3.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.255 -0.903 . . . . 0.0 109.901 179.746 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.411 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -137.83 177.92 1.92 Allowed Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 -179.637 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.7 Cg_endo -70.32 -31.41 18.09 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.364 1.191 . . . . 0.0 110.974 179.995 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.416 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.2 OUTLIER -87.6 -43.78 11.72 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.972 -1.08 . . . . 0.0 109.842 179.501 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.8 t -60.12 -49.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.636 179.842 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtp-105 -59.61 -50.85 72.26 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.038 -1.039 . . . . 0.0 109.332 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.07 -39.96 91.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.214 -0.929 . . . . 0.0 108.85 178.821 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 19' ' ' SER . 86.9 m -54.37 -42.84 70.79 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.057 -1.027 . . . . 0.0 108.611 178.32 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -62.73 -37.47 86.69 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 119.63 -0.828 . . . . 0.0 109.109 178.066 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.8 49.54 1.09 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.156 -0.965 . . . . 0.0 110.529 -179.727 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.89 40.31 2.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.096 -1.002 . . . . 0.0 109.782 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.37 148.96 19.95 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.666 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -79.64 -9.11 59.58 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.298 -1.119 . . . . 0.0 111.064 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -91.47 -21.34 20.97 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.678 -1.264 . . . . 0.0 111.449 179.657 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -48.49 -37.52 17.67 Favored 'General case' 0 N--CA 1.518 2.953 0 O-C-N 120.743 -1.223 . . . . 0.0 110.968 -179.559 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -63.11 -54.26 40.71 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.092 -1.005 . . . . 0.0 108.981 179.241 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.26 -39.2 85.99 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.0 178.609 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.88 -37.37 68.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.167 -0.958 . . . . 0.0 110.103 179.218 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE2' ' A' ' 8' ' ' TYR . 69.4 t -56.13 -35.34 41.59 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 O-C-N 120.993 -1.067 . . . . 0.0 110.066 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.5 tptm -52.4 -39.93 61.5 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.905 -1.122 . . . . 0.0 110.056 179.562 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.67 -29.6 64.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -69.96 -53.04 19.56 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.901 -1.124 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -100.0 34.76 2.21 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.124 -0.985 . . . . 0.0 111.227 179.793 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.08 -35.86 23.44 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.744 -1.222 . . . . 0.0 110.3 178.978 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -105.17 23.23 13.99 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.043 -1.035 . . . . 0.0 111.289 179.553 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 14.9 t90 -99.76 -45.28 5.8 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.855 -1.153 . . . . 0.0 110.152 179.89 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -124.34 42.18 3.32 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.125 -0.984 . . . . 0.0 110.094 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.12 -75.46 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.294 -0.878 . . . . 0.0 110.919 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -168.97 44.36 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.775 -1.203 . . . . 0.0 111.124 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -147.47 75.38 1.36 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 179.954 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -155.93 74.57 0.86 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.25 -0.906 . . . . 0.0 110.74 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -118.43 36.62 4.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.178 -0.951 . . . . 0.0 110.518 179.676 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -113.22 -54.94 2.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.183 -0.948 . . . . 0.0 109.721 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.55 63.54 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.288 -0.883 . . . . 0.0 111.328 179.405 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 HD13 ' CD1' ' A' ' 38' ' ' TYR . 46.8 mm -68.88 -40.93 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 120.693 -1.255 . . . . 0.0 109.464 179.597 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.75 -41.35 17.72 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.17 -0.956 . . . . 0.0 109.76 179.663 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -60.86 -32.41 71.83 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.288 -0.883 . . . . 0.0 110.457 179.676 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 83.3 m . . . . . 0 N--CA 1.504 2.253 0 O-C-N 120.977 -1.077 . . . . 0.0 110.323 -179.975 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 12' ' ' TYR . 91.4 mttt . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -104.57 148.85 26.05 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.3 -0.875 . . . . 0.0 109.465 179.47 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -125.08 130.15 51.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.2 -0.938 . . . . 0.0 110.542 -179.407 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.0 t -109.98 93.87 4.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.182 -0.949 . . . . 0.0 109.686 179.375 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -51.74 -36.41 47.04 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 121.158 -0.964 . . . . 0.0 111.035 -179.427 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.429 ' CD2' HG23 ' A' ' 34' ' ' VAL . 27.8 m-85 -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.053 -1.029 . . . . 0.0 110.114 179.461 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -96.42 -4.23 42.12 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.002 -1.061 . . . . 0.0 111.952 179.605 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 53.68 47.25 24.21 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.428 -1.42 . . . . 0.0 110.66 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 t -140.95 171.26 14.32 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.265 -0.897 . . . . 0.0 110.373 179.852 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE2' ' CD ' ' A' ' 3' ' ' LYS . 12.1 t80 -126.66 104.68 8.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.991 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.4 mp -65.22 163.48 15.16 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.868 -179.739 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.4 t -99.3 -31.05 11.89 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.199 -0.938 . . . . 0.0 111.591 -179.611 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -114.23 136.42 52.98 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.823 -1.173 . . . . 0.0 110.076 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -114.31 92.09 3.84 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.155 -0.966 . . . . 0.0 109.849 179.66 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.402 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.12 179.04 1.47 Allowed Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.232 -0.918 . . . . 0.0 109.983 -179.601 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.16 -30.84 15.52 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.293 1.154 . . . . 0.0 111.028 179.994 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 6.1 m -89.27 -43.73 10.76 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.942 -1.099 . . . . 0.0 109.887 179.607 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.9 t -59.26 -52.48 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.58 0 O-C-N 121.121 -0.987 . . . . 0.0 109.833 179.832 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 mtp-105 -58.2 -50.08 74.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.135 -0.978 . . . . 0.0 109.511 179.817 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt -61.47 -40.06 93.16 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.291 -0.963 . . . . 0.0 108.88 178.72 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 79.4 m -54.29 -43.03 70.71 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.109 -0.994 . . . . 0.0 108.539 178.269 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -62.7 -37.91 88.34 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.96 177.961 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.92 52.09 1.15 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.178 -0.952 . . . . 0.0 110.188 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.37 38.05 3.36 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.051 -1.031 . . . . 0.0 110.392 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.78 126.47 2.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.976 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -53.95 -28.72 38.98 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.107 -1.231 . . . . 0.0 110.378 179.217 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -60.4 -31.54 70.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 0.0 110.645 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.3 t-80 -49.52 -37.97 28.86 Favored 'General case' 0 N--CA 1.516 2.832 0 O-C-N 120.933 -1.105 . . . . 0.0 110.964 -179.564 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -62.23 -54.23 43.78 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.072 -1.018 . . . . 0.0 109.118 179.3 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.38 -38.43 83.89 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.123 178.612 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -56.57 -37.65 70.87 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.274 -0.891 . . . . 0.0 110.18 179.321 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.429 HG23 ' CD2' ' A' ' 8' ' ' TYR . 95.1 t -59.62 -39.32 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.123 -0.986 . . . . 0.0 109.722 179.645 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 52.3 mttt -54.06 -40.91 67.59 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.016 -1.052 . . . . 0.0 109.606 179.331 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.42 -34.92 69.44 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.052 178.993 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -62.15 -52.56 63.36 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.002 -1.061 . . . . 0.0 109.602 179.649 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.425 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 49.8 p90 -100.94 38.0 1.63 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.276 -0.89 . . . . 0.0 110.781 179.412 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -87.0 -37.35 17.6 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.927 -1.108 . . . . 0.0 110.067 178.874 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.35 19.25 14.7 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.179 -0.951 . . . . 0.0 111.179 179.244 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 17.6 t90 -105.86 -55.98 2.25 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.809 -1.182 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.1 tpp -143.14 57.98 1.4 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.864 . . . . 0.0 109.855 179.963 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.22 89.23 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.525 0 O-C-N 121.206 -0.934 . . . . 0.0 110.254 -179.69 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.08 -58.73 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.249 -0.907 . . . . 0.0 110.733 179.891 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -159.71 76.32 0.65 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.302 -0.873 . . . . 0.0 110.722 179.868 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.15 71.0 1.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.182 -0.949 . . . . 0.0 110.386 -179.816 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.67 32.81 5.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.174 -0.954 . . . . 0.0 110.657 179.406 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -104.07 -48.67 3.82 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.08 -1.012 . . . . 0.0 109.568 179.297 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -21.25 62.78 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.169 -0.957 . . . . 0.0 111.469 179.491 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.414 HD12 ' OH ' ' A' ' 8' ' ' TYR . 50.3 mm -82.12 -53.11 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 120.646 -1.284 . . . . 0.0 109.945 179.728 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -56.88 -39.57 74.6 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.135 -0.978 . . . . 0.0 110.32 -179.855 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -57.14 -36.57 70.87 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.148 -0.97 . . . . 0.0 110.54 -179.922 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m . . . . . 0 N--CA 1.505 2.3 0 O-C-N 121.074 -1.016 . . . . 0.0 110.483 179.948 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 20.3 mtmt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 21' ' ' ARG . 40.7 t80 -113.53 154.42 27.13 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.286 -0.884 . . . . 0.0 109.609 179.564 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -126.45 133.82 51.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.053 -1.029 . . . . 0.0 110.538 -179.851 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 45.9 t -109.8 97.7 7.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.502 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -54.32 -36.57 63.89 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.094 -1.004 . . . . 0.0 110.272 179.715 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.0 m-85 -59.84 -32.37 70.61 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.185 179.082 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -97.02 -1.81 44.7 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.984 -1.073 . . . . 0.0 112.098 -179.894 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.63 39.17 27.79 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.352 -1.468 . . . . 0.0 110.399 -179.589 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 t -145.83 175.31 10.51 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.174 -179.972 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -122.03 122.67 39.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.363 -0.835 . . . . 0.0 110.285 -179.624 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.408 HD23 ' CG ' ' A' ' 24' ' ' HIS . 4.2 mp -76.44 170.41 16.42 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.101 -0.999 . . . . 0.0 109.506 179.283 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.9 t -100.15 -29.4 12.51 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.173 -0.954 . . . . 0.0 111.799 -179.661 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -110.94 146.53 36.43 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.758 -1.214 . . . . 0.0 110.388 -179.91 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -125.38 93.68 3.93 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.772 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.411 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.75 176.7 2.08 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.25 -0.906 . . . . 0.0 110.27 -179.611 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -69.59 -32.08 19.99 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.401 1.211 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.416 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.7 t -86.05 -39.5 16.74 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.954 -1.091 . . . . 0.0 109.973 179.5 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.7 t -63.38 -47.39 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.208 -0.932 . . . . 0.0 109.595 179.751 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 mtt180 -58.29 -51.64 68.94 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.082 -1.011 . . . . 0.0 109.632 179.941 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -62.29 -41.13 98.24 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.789 179.012 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 19' ' ' SER . 96.8 m -55.68 -43.17 76.11 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.074 -1.016 . . . . 0.0 108.522 178.324 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.408 ' CG ' HD23 ' A' ' 13' ' ' LEU . 72.3 t60 -61.83 -35.35 77.98 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.644 -0.823 . . . . 0.0 109.288 178.02 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -98.92 44.42 1.03 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.051 -1.03 . . . . 0.0 110.651 -179.795 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m -116.76 39.75 3.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.117 -0.989 . . . . 0.0 109.749 179.626 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.38 163.54 21.88 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -179.667 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -89.18 -11.72 42.97 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.281 -1.129 . . . . 0.0 110.842 178.689 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.69 -26.18 19.69 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.729 -1.232 . . . . 0.0 111.087 179.659 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -50.67 -39.58 51.37 Favored 'General case' 0 N--CA 1.516 2.858 0 O-C-N 120.737 -1.227 . . . . 0.0 110.546 -179.577 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -64.13 -54.37 34.83 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.945 179.17 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -60.81 -39.53 89.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.116 178.588 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.2 -38.04 73.09 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.261 -0.899 . . . . 0.0 109.988 179.194 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CE1' ' A' ' 8' ' ' TYR . 78.9 t -56.81 -37.76 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 121.036 -1.04 . . . . 0.0 109.964 179.703 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.5 ttpp -54.87 -41.24 70.6 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.966 -1.084 . . . . 0.0 109.716 179.435 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.64 -32.0 68.66 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.868 . . . . 0.0 110.15 178.963 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -67.66 -52.29 39.74 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.093 -1.004 . . . . 0.0 110.158 179.899 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.2 p90 -100.22 33.12 2.75 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.12 -0.987 . . . . 0.0 111.33 179.622 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -79.49 -36.89 37.97 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.755 -1.216 . . . . 0.0 110.144 179.026 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -112.78 31.41 6.4 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.172 -0.955 . . . . 0.0 110.984 179.833 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.5 t90 -84.33 -38.94 19.75 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.085 -1.01 . . . . 0.0 110.219 179.925 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.446 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -153.72 -65.26 0.15 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.121 -0.987 . . . . 0.0 110.674 179.983 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.4 -164.64 1.51 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.19 -0.944 . . . . 0.0 110.15 -179.736 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -112.58 39.01 2.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.191 -0.943 . . . . 0.0 110.303 179.877 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -151.17 73.73 1.11 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.167 -0.958 . . . . 0.0 110.43 179.874 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.11 70.64 1.37 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.219 -0.926 . . . . 0.0 110.217 -179.945 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.85 34.56 4.75 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.224 -0.922 . . . . 0.0 110.516 179.646 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.4 m -107.28 -53.05 2.67 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.152 -0.967 . . . . 0.0 109.243 179.184 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.04 -21.37 63.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.244 -0.91 . . . . 0.0 111.225 179.203 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.482 HD11 HG22 ' A' ' 50' ' ' ILE . 49.9 mm -77.56 -54.87 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.604 -1.31 . . . . 0.0 109.534 179.603 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.61 -40.97 93.8 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.69 -35.82 73.24 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.175 -0.953 . . . . 0.0 110.333 179.782 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m . . . . . 0 N--CA 1.506 2.347 0 O-C-N 120.995 -1.065 . . . . 0.0 110.308 179.717 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.432 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 16.2 mtmm . . . . . 0 N--CA 1.503 2.183 0 CA-C-O 120.877 0.37 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.422 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 63.7 t80 -54.0 159.16 1.86 Allowed 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.083 -1.01 . . . . 0.0 111.049 -179.493 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -141.71 130.91 23.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.887 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.5 t -113.39 92.36 3.97 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.095 -1.003 . . . . 0.0 110.449 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -53.57 -35.69 61.07 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.024 -1.048 . . . . 0.0 110.233 179.482 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 34' ' ' VAL . 86.0 m-85 -59.75 -35.42 74.54 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.134 -0.979 . . . . 0.0 109.975 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.3 m -93.54 1.08 56.85 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.186 -0.946 . . . . 0.0 112.075 179.971 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.1 38.34 23.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.453 -1.404 . . . . 0.0 110.749 -179.843 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -141.17 168.42 19.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.203 -0.936 . . . . 0.0 110.147 179.908 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.432 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 33.0 t80 -122.84 133.0 54.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.302 -0.874 . . . . 0.0 110.307 -179.739 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.1 mp -89.23 163.85 15.22 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.11 -0.994 . . . . 0.0 109.721 179.591 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.412 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -99.56 -30.81 11.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.081 -1.012 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.412 ' CD2' HG21 ' A' ' 14' ' ' THR . 44.1 m-70 -114.85 136.1 53.46 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.79 -1.194 . . . . 0.0 110.231 -179.858 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -112.92 92.85 4.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.219 -0.926 . . . . 0.0 109.826 179.75 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.85 178.77 1.51 Allowed Pre-proline 0 N--CA 1.494 1.732 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.715 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.62 -29.58 19.54 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 O-C-N 123.377 1.199 . . . . 0.0 111.137 -179.91 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.422 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.8 t -88.91 -43.56 11.09 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.948 -1.095 . . . . 0.0 109.936 179.538 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.5 t -59.83 -52.65 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.762 179.756 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 31.2 mtp-105 -58.03 -49.9 75.27 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.122 -0.986 . . . . 0.0 109.546 179.784 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -61.54 -40.35 94.35 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.841 178.689 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 19' ' ' SER . 65.1 m -54.25 -42.71 70.21 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.105 -0.997 . . . . 0.0 108.639 178.407 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -63.14 -38.65 92.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.606 -0.838 . . . . 0.0 109.075 178.198 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -95.2 53.4 1.52 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.221 -0.924 . . . . 0.0 110.457 -179.702 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.79 40.28 2.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.168 -0.957 . . . . 0.0 109.782 179.618 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.21 147.41 19.19 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 -179.74 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -79.93 -10.36 59.77 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.224 -1.163 . . . . 0.0 111.047 178.864 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -90.54 -19.36 23.86 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.632 -1.293 . . . . 0.0 111.467 179.657 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -48.63 -40.32 27.26 Favored 'General case' 0 N--CA 1.517 2.925 0 O-C-N 120.681 -1.262 . . . . 0.0 110.907 -179.758 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.15 -52.81 57.25 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.743 179.118 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.29 -38.93 88.56 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.235 -0.915 . . . . 0.0 108.987 178.452 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -55.43 -37.79 68.14 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 8' ' ' TYR . 60.9 t -57.87 -37.49 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.139 -0.976 . . . . 0.0 109.788 179.576 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 27.3 tttt -54.42 -41.11 68.96 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.874 -1.141 . . . . 0.0 109.763 179.38 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.5 -27.95 64.94 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.366 178.961 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -71.35 -53.02 15.56 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.897 -1.127 . . . . 0.0 110.089 179.983 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.85 33.68 2.49 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.151 -0.968 . . . . 0.0 111.256 179.624 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -81.67 -37.25 27.73 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.767 -1.208 . . . . 0.0 110.145 179.027 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -100.06 20.92 13.58 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.195 -0.941 . . . . 0.0 111.212 179.332 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 15.0 t90 -102.6 -48.62 4.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.837 -1.165 . . . . 0.0 109.951 179.77 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.46 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -124.98 -58.13 1.48 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.24 -0.912 . . . . 0.0 109.997 179.725 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 54.0 38.73 29.51 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.922 -1.111 . . . . 0.0 110.822 179.998 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -145.87 -61.38 0.33 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.169 -0.957 . . . . 0.0 110.156 179.863 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -151.24 74.91 1.16 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.158 -0.964 . . . . 0.0 110.459 179.845 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.25 71.36 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.193 -0.942 . . . . 0.0 110.469 -179.824 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -123.32 32.33 5.69 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.223 -0.923 . . . . 0.0 110.689 179.364 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.02 -48.25 3.94 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.082 -1.011 . . . . 0.0 109.687 179.271 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -21.23 62.33 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.197 -0.94 . . . . 0.0 111.492 179.342 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.424 HD13 ' CE2' ' A' ' 38' ' ' TYR . 50.9 mm -80.85 -40.2 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.666 -1.272 . . . . 0.0 110.001 179.861 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -80.43 -40.98 25.32 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.194 -0.941 . . . . 0.0 109.897 179.791 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -33.27 69.34 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.21 -0.931 . . . . 0.0 110.558 179.751 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.504 2.245 0 O-C-N 120.944 -1.097 . . . . 0.0 110.489 -179.982 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.424 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 15.8 mmtt . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 . . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 76.0 t80 -114.57 161.89 17.46 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.992 179.689 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -142.78 131.34 22.45 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.251 -0.906 . . . . 0.0 110.223 -179.457 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.7 t -108.08 92.25 3.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.132 -0.98 . . . . 0.0 110.012 179.339 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -51.44 -35.54 39.95 Favored 'General case' 0 N--CA 1.515 2.824 0 O-C-N 121.151 -0.968 . . . . 0.0 110.539 -179.989 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.431 ' CE2' HG12 ' A' ' 34' ' ' VAL . 79.6 m-85 -61.62 -31.04 71.1 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.059 -1.025 . . . . 0.0 110.144 179.068 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.4 m -100.8 -4.21 28.43 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.936 -1.102 . . . . 0.0 112.334 -179.856 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 t70 54.21 38.68 29.73 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.347 -1.471 . . . . 0.0 110.453 -179.614 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -137.03 169.78 17.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.218 -0.926 . . . . 0.0 109.745 179.785 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 13.9 t80 -119.34 139.54 51.8 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.207 -0.933 . . . . 0.0 110.641 -179.549 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -104.01 155.83 18.35 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.287 -0.883 . . . . 0.0 109.471 179.396 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 t -103.56 -29.43 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.076 -1.015 . . . . 0.0 112.293 -179.122 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -109.62 86.53 2.31 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.778 -1.201 . . . . 0.0 110.481 -179.734 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -73.78 71.08 1.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.24 -0.913 . . . . 0.0 110.169 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.45 179.77 0.73 Allowed Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 109.934 179.965 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -71.7 -31.35 13.32 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.292 1.154 . . . . 0.0 111.067 -179.915 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 58.5 m -85.53 -46.49 10.79 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.943 -1.098 . . . . 0.0 109.832 179.58 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.6 t -59.06 -52.26 62.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.089 -1.007 . . . . 0.0 109.719 179.802 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 3.1 mtt180 -56.7 -51.44 68.8 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.097 -1.002 . . . . 0.0 109.696 179.842 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -61.6 -40.49 95.0 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.766 178.816 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.0 m -55.16 -43.43 74.27 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.056 -1.027 . . . . 0.0 108.408 178.273 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.029 178.052 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -97.8 47.53 1.01 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.241 -0.912 . . . . 0.0 110.513 -179.697 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -116.21 40.23 2.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.139 -0.976 . . . . 0.0 109.815 179.493 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.11 150.36 20.16 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -179.705 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -81.14 -10.04 59.71 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.232 -1.157 . . . . 0.0 111.031 178.844 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mttp -90.46 -21.55 21.82 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.7 -1.25 . . . . 0.0 111.408 179.602 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -48.33 -37.55 16.85 Favored 'General case' 0 N--CA 1.518 2.97 0 O-C-N 120.806 -1.184 . . . . 0.0 110.998 -179.735 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -63.79 -54.44 35.08 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -60.4 -39.47 87.45 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.273 -0.892 . . . . 0.0 108.968 178.748 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -55.68 -37.41 68.29 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.224 -0.923 . . . . 0.0 110.11 179.158 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' CE2' ' A' ' 8' ' ' TYR . 53.0 t -55.67 -35.34 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.015 -1.053 . . . . 0.0 110.222 179.74 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 62.8 tttt -53.1 -41.33 64.85 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.876 -1.14 . . . . 0.0 110.025 179.659 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.67 -28.91 66.18 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.296 -0.877 . . . . 0.0 110.382 178.952 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -68.45 -51.75 40.22 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 120.895 -1.128 . . . . 0.0 110.368 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.1 p90 -100.07 35.55 2.04 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.016 -1.053 . . . . 0.0 111.196 179.753 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -39.23 12.94 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.88 -1.138 . . . . 0.0 109.843 178.72 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -111.65 31.01 6.47 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.297 -0.877 . . . . 0.0 110.639 179.378 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.3 t90 -94.62 -40.26 9.92 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.082 -1.011 . . . . 0.0 110.152 -179.901 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.446 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -148.47 -63.89 0.25 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 179.954 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -146.79 -164.56 2.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.119 -0.988 . . . . 0.0 110.199 -179.908 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -111.39 39.76 2.24 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.137 -0.977 . . . . 0.0 110.143 179.884 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -144.54 74.45 1.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.233 -0.917 . . . . 0.0 110.216 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.44 71.81 1.3 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.194 -0.941 . . . . 0.0 110.355 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -114.7 35.02 4.45 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.22 -0.925 . . . . 0.0 110.493 179.663 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.2 p -108.37 -53.12 2.67 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.084 -1.01 . . . . 0.0 109.419 179.315 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -20.68 63.98 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.154 -0.966 . . . . 0.0 111.35 179.39 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.6 mm -74.82 -44.08 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.557 -1.339 . . . . 0.0 109.685 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.84 -41.46 95.86 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.193 -0.942 . . . . 0.0 109.826 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -59.8 -36.22 76.31 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.262 179.872 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.505 2.278 0 O-C-N 121.058 -1.026 . . . . 0.0 110.329 179.743 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 N--CA 1.5 2.054 0 CA-C-O 120.852 0.358 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 5' ' ' TYR . 57.4 t80 -130.51 162.28 29.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.048 -1.033 . . . . 0.0 110.013 -179.683 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 33.4 t80 -135.52 132.65 37.55 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.177 -0.952 . . . . 0.0 110.532 -179.583 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.7 t -110.65 90.09 3.23 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.214 -0.929 . . . . 0.0 109.633 179.248 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -50.06 -34.92 23.17 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.131 -0.981 . . . . 0.0 111.197 -179.603 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.414 ' CD1' HG12 ' A' ' 34' ' ' VAL . 25.2 m-85 -64.17 -32.24 73.74 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.848 179.526 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 43.7 m -95.98 -6.36 39.08 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.971 -1.081 . . . . 0.0 112.041 179.696 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 t70 55.81 39.68 30.71 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.447 -1.408 . . . . 0.0 110.352 -179.456 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -140.24 169.68 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 109.79 179.82 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -120.55 144.56 48.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.148 -0.97 . . . . 0.0 110.563 -179.685 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 mp -102.97 166.42 10.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.16 -0.962 . . . . 0.0 109.771 179.543 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.41 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -104.41 -29.96 10.38 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.103 -0.998 . . . . 0.0 112.285 -179.17 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.41 ' CD2' HG21 ' A' ' 14' ' ' THR . 51.2 m-70 -112.68 124.19 52.0 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.7 -1.25 . . . . 0.0 110.451 -179.577 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -98.69 64.95 1.53 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.107 -0.996 . . . . 0.0 110.408 179.907 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.78 178.36 0.98 Allowed Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.214 -0.929 . . . . 0.0 109.96 179.825 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.07 -35.94 6.44 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.359 1.189 . . . . 0.0 110.736 -179.939 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 3.3 t -76.23 -39.54 54.27 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.063 -1.023 . . . . 0.0 110.011 179.711 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.6 t -58.94 -54.53 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.112 -0.993 . . . . 0.0 109.856 179.923 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -55.37 -50.85 68.63 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.054 -1.029 . . . . 0.0 109.793 179.946 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -62.0 -40.85 97.06 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.797 178.77 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 86.3 m -56.43 -44.17 80.16 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.082 -1.011 . . . . 0.0 108.318 178.324 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -63.21 -38.29 90.6 Favored 'General case' 0 N--CA 1.503 2.192 0 C-N-CA 119.66 -0.816 . . . . 0.0 108.869 178.11 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.9 t -94.34 55.1 1.95 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.307 -0.871 . . . . 0.0 110.206 -179.988 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -114.85 39.84 2.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 110.005 179.759 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -138.52 152.14 21.89 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -81.22 -11.96 59.27 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.238 -1.154 . . . . 0.0 111.183 179.053 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -90.99 -20.92 21.59 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.694 -1.254 . . . . 0.0 111.456 179.704 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -49.0 -42.39 37.73 Favored 'General case' 0 N--CA 1.518 2.929 0 O-C-N 120.715 -1.24 . . . . 0.0 111.007 -179.627 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 mtmt -62.52 -55.05 31.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.129 -0.982 . . . . 0.0 109.019 179.356 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -38.48 83.03 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.15 178.612 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.08 -39.65 75.39 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.274 -0.891 . . . . 0.0 109.935 179.359 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.414 HG12 ' CD1' ' A' ' 8' ' ' TYR . 96.9 t -62.71 -36.2 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.174 -0.954 . . . . 0.0 109.823 179.476 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.2 ttpp -52.33 -39.86 61.2 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 120.998 -1.064 . . . . 0.0 110.079 179.444 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.64 -32.13 68.77 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.195 178.985 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -66.65 -52.42 45.12 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.86 -1.15 . . . . 0.0 110.144 179.933 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.1 33.59 2.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.087 -1.008 . . . . 0.0 111.297 179.592 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -36.41 39.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.783 -1.198 . . . . 0.0 110.163 179.006 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -111.13 30.05 7.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.16 -0.963 . . . . 0.0 110.969 179.701 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 26.2 t90 -92.53 -39.79 11.17 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.119 -0.988 . . . . 0.0 110.124 179.888 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.429 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.6 tpp -143.65 -59.95 0.4 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.115 -0.991 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -151.99 -170.32 3.61 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.211 -0.93 . . . . 0.0 110.392 -179.803 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -106.29 52.77 0.72 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.1 -1.0 . . . . 0.0 110.157 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -166.36 73.47 0.16 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.187 -0.945 . . . . 0.0 110.775 179.962 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 38' ' ' TYR . . . -146.14 72.07 1.28 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.266 -0.897 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -110.93 36.08 3.28 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.238 -0.914 . . . . 0.0 110.32 179.573 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -110.4 -54.07 2.62 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.151 -0.968 . . . . 0.0 109.617 179.436 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.403 ' O ' ' OG1' ' A' ' 53' ' ' THR . 0.6 OUTLIER -60.87 -21.41 63.25 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.244 -0.91 . . . . 0.0 111.458 179.508 . . . . . . . . 3 3 . 1 . 045 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.421 HG13 ' CE2' ' A' ' 38' ' ' TYR . 46.7 mm -70.5 -40.86 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.569 -1.332 . . . . 0.0 109.672 179.651 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -34.83 79.31 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.147 -0.971 . . . . 0.0 110.474 179.838 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -90.08 -39.36 12.94 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.034 -1.041 . . . . 0.0 110.403 179.895 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 49' ' ' LEU . 85.3 m . . . . . 0 N--CA 1.508 2.449 0 O-C-N 121.13 -0.981 . . . . 0.0 110.005 179.897 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.422 ' HB2' ' CZ ' ' A' ' 12' ' ' TYR . 46.9 mttt . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -112.4 161.9 16.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.9 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -131.28 138.28 49.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.165 -0.96 . . . . 0.0 110.401 -179.719 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.5 t -116.83 96.95 5.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.156 -0.965 . . . . 0.0 109.955 179.46 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -51.53 -35.63 41.47 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.014 -1.054 . . . . 0.0 110.658 -179.991 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CE2' HG12 ' A' ' 34' ' ' VAL . 81.8 m-85 -63.14 -31.07 72.12 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.132 -0.98 . . . . 0.0 110.202 179.252 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 51.7 m -100.07 -10.14 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.972 -1.08 . . . . 0.0 112.055 -179.939 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t0 56.39 40.76 29.6 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.405 -1.434 . . . . 0.0 110.167 -179.464 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -141.76 172.49 12.61 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.221 -0.924 . . . . 0.0 109.985 179.944 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CZ ' ' HB2' ' A' ' 3' ' ' LYS . 5.0 t80 -119.96 135.1 55.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.17 -0.956 . . . . 0.0 110.575 -179.72 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.7 mp -91.48 170.28 10.08 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.234 -0.916 . . . . 0.0 109.687 179.537 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.421 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -97.58 -31.68 12.19 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.175 -0.953 . . . . 0.0 111.388 -179.717 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.421 ' CD2' HG21 ' A' ' 14' ' ' THR . 39.3 m-70 -116.05 135.86 53.56 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.849 -1.157 . . . . 0.0 110.125 179.989 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.01 95.85 5.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.149 -0.969 . . . . 0.0 109.882 179.822 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.73 177.74 1.68 Allowed Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.905 . . . . 0.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.5 -32.15 16.01 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.398 1.209 . . . . 0.0 110.969 179.824 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.405 ' O ' ' OG1' ' A' ' 23' ' ' THR . 26.8 m -85.11 -40.26 16.97 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.933 -1.105 . . . . 0.0 109.979 179.562 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.5 t -63.18 -49.52 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.135 -0.978 . . . . 0.0 109.688 179.793 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.6 mtm-85 -55.93 -52.14 65.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.061 -1.024 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -61.15 -40.28 93.26 Favored 'General case' 0 N--CA 1.509 2.48 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.883 178.811 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.9 m -55.49 -43.44 75.61 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.085 -1.009 . . . . 0.0 108.368 178.345 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -62.17 -38.8 90.42 Favored 'General case' 0 N--CA 1.504 2.227 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 177.974 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.5 t -95.83 52.34 1.32 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.218 -0.926 . . . . 0.0 110.373 -179.89 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -120.0 37.36 4.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.094 -1.003 . . . . 0.0 110.256 179.775 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.07 128.53 3.45 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.948 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -54.03 -28.89 41.2 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.168 -1.195 . . . . 0.0 110.423 179.199 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -59.75 -35.39 74.49 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.958 -1.089 . . . . 0.0 110.352 179.906 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -51.25 -38.98 55.66 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.925 -1.11 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -62.18 -55.42 28.8 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.164 -0.96 . . . . 0.0 109.131 179.381 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -59.36 -39.45 83.32 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.249 -0.907 . . . . 0.0 109.124 178.766 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -56.44 -38.39 71.55 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.317 -0.864 . . . . 0.0 109.97 179.252 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.43 HG12 ' CE2' ' A' ' 8' ' ' TYR . 72.3 t -58.92 -37.11 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.15 -0.969 . . . . 0.0 109.952 179.743 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 31.2 mtmt -53.37 -41.46 65.87 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.969 -1.082 . . . . 0.0 109.863 179.768 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -58.38 -32.37 68.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.311 -0.868 . . . . 0.0 110.152 178.891 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -63.48 -51.31 66.13 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.027 -1.046 . . . . 0.0 110.151 179.935 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 47.7 p90 -100.66 36.27 1.96 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.09 -1.006 . . . . 0.0 111.151 179.62 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.15 -37.79 14.78 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.882 -1.137 . . . . 0.0 110.131 178.887 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.96 27.96 9.07 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.194 -0.941 . . . . 0.0 111.014 179.568 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.44 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.0 t90 -92.81 -40.49 10.62 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.989 -1.069 . . . . 0.0 110.198 179.921 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.44 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -149.18 -63.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.097 -1.002 . . . . 0.0 110.502 179.954 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.54 2.18 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.207 -0.933 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -109.8 39.42 2.13 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -0.98 . . . . 0.0 110.259 179.787 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -148.45 75.69 1.33 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.157 -0.964 . . . . 0.0 110.299 179.885 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.9 74.67 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.294 -0.879 . . . . 0.0 110.251 -179.836 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.91 35.01 3.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.173 -0.955 . . . . 0.0 110.46 179.611 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.3 p -109.16 -54.75 2.5 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.084 -1.01 . . . . 0.0 109.189 179.152 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -20.51 65.0 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.283 -0.885 . . . . 0.0 111.175 179.154 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.7 mm -75.24 -40.22 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.67 -1.269 . . . . 0.0 109.837 179.778 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -40.42 73.33 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.175 -0.953 . . . . 0.0 109.957 179.942 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -58.2 -35.66 71.97 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.252 -0.905 . . . . 0.0 110.488 179.967 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.0 m . . . . . 0 N--CA 1.503 2.216 0 O-C-N 121.091 -1.006 . . . . 0.0 110.155 179.848 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -113.31 161.77 16.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.065 -1.022 . . . . 0.0 109.998 179.93 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -137.76 133.66 34.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.272 -0.892 . . . . 0.0 110.278 -179.687 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 t -114.45 98.18 6.75 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.201 -0.937 . . . . 0.0 109.718 179.382 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -56.32 -36.96 69.31 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.101 -0.999 . . . . 0.0 110.758 -179.434 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.429 ' CD1' HG12 ' A' ' 34' ' ' VAL . 27.8 m-85 -61.93 -32.66 73.08 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.953 -1.092 . . . . 0.0 110.169 179.555 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.8 m -93.31 -6.15 48.07 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.95 -1.094 . . . . 0.0 111.897 179.456 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.71 39.48 31.34 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.443 -1.41 . . . . 0.0 110.437 -179.688 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -142.12 168.08 20.59 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.253 -0.905 . . . . 0.0 109.895 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -118.23 139.99 50.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.571 -179.706 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -97.62 166.3 11.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.24 -0.912 . . . . 0.0 109.657 179.565 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.4 t -100.91 -30.63 11.55 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.128 -0.983 . . . . 0.0 111.881 -179.452 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -118.11 134.98 54.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.799 -1.188 . . . . 0.0 110.226 -179.871 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -112.3 96.73 6.18 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.198 -0.939 . . . . 0.0 109.818 179.685 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -142.52 177.9 1.69 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 -179.568 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.87 -29.95 22.54 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.416 1.219 . . . . 0.0 111.039 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 23' ' ' THR . 7.0 t -88.72 -44.04 10.85 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.927 -1.108 . . . . 0.0 109.867 179.396 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.2 -48.96 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.562 0 O-C-N 121.196 -0.94 . . . . 0.0 109.468 179.574 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -59.15 -50.65 73.22 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 109.25 179.541 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -61.7 -40.37 94.79 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.2 -0.937 . . . . 0.0 108.788 178.7 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 23' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 19' ' ' SER . 88.2 m -54.66 -43.57 72.52 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.042 -1.036 . . . . 0.0 108.455 178.292 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -63.38 -40.36 97.04 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.949 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -94.36 55.7 2.03 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.29 -0.881 . . . . 0.0 110.097 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.95 37.5 3.63 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.18 -0.95 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.08 125.62 2.14 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -179.952 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ttp85 -54.28 -28.34 41.32 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.207 -1.172 . . . . 0.0 110.436 179.157 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -61.22 -31.57 71.35 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.949 -1.094 . . . . 0.0 110.626 179.882 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -49.35 -38.82 29.54 Favored 'General case' 0 N--CA 1.515 2.782 0 O-C-N 120.903 -1.123 . . . . 0.0 110.937 -179.503 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -63.73 -55.2 25.02 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.101 -1.0 . . . . 0.0 109.039 179.339 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -60.33 -38.99 85.46 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.136 178.682 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -57.16 -36.81 71.22 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.215 -0.928 . . . . 0.0 110.222 179.27 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.429 HG12 ' CD1' ' A' ' 8' ' ' TYR . 97.3 t -58.04 -38.69 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.069 -1.019 . . . . 0.0 109.908 179.898 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 11.3 mttt -58.59 -42.09 87.3 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.009 -1.057 . . . . 0.0 109.454 179.227 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -59.48 -31.15 69.08 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.035 178.805 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.411 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 51.2 t80 -67.36 -51.54 50.92 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.012 -1.055 . . . . 0.0 110.346 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 42.4 p90 -99.25 29.84 3.76 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.036 -1.04 . . . . 0.0 111.695 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -78.37 -39.75 38.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.652 -1.28 . . . . 0.0 109.732 178.666 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -115.36 36.87 3.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 179.41 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.9 t90 -92.26 -38.5 12.05 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.175 -0.953 . . . . 0.0 110.19 -179.771 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -147.11 -65.51 0.27 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.16 -0.962 . . . . 0.0 110.347 179.89 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.89 -163.11 1.66 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.205 -0.934 . . . . 0.0 110.152 -179.878 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -103.66 -177.5 3.39 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.104 -0.998 . . . . 0.0 110.073 179.791 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 53.28 74.54 0.3 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.025 -1.047 . . . . 0.0 110.608 -179.743 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.41 70.15 1.42 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.247 -0.908 . . . . 0.0 110.166 -179.967 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.64 33.61 5.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.254 -0.904 . . . . 0.0 110.629 179.595 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.96 -53.04 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.022 -1.049 . . . . 0.0 109.009 179.032 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.8 -20.54 65.12 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.331 -0.855 . . . . 0.0 111.181 178.943 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.43 HG13 ' CE1' ' A' ' 38' ' ' TYR . 50.9 mm -81.53 -55.52 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 120.724 -1.235 . . . . 0.0 109.803 179.714 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -54.64 -38.97 67.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.552 -179.833 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.93 -36.69 82.12 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 179.975 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.503 2.218 0 O-C-N 121.026 -1.046 . . . . 0.0 110.379 179.916 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.98 171.29 17.81 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.438 1.231 . . . . 0.0 110.448 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.4 mttt 61.27 140.53 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.3 -0.875 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -112.71 157.71 20.95 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.99 -1.069 . . . . 0.0 109.979 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -136.36 140.22 43.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.187 -0.946 . . . . 0.0 110.471 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.7 t -110.45 97.41 6.86 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.134 -0.979 . . . . 0.0 110.136 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -52.36 -35.87 52.32 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.036 -1.04 . . . . 0.0 110.534 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 93.2 m-85 -62.67 -33.06 74.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.135 -0.978 . . . . 0.0 110.243 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.3 m -100.11 -3.05 32.65 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.028 -1.045 . . . . 0.0 112.282 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 53.24 38.3 27.3 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.409 -1.432 . . . . 0.0 110.75 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 t -129.32 173.53 10.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.158 -0.964 . . . . 0.0 110.03 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -123.69 108.68 12.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 110.099 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mp -69.57 157.08 37.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.147 -0.971 . . . . 0.0 109.905 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.401 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -101.95 -31.15 10.82 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.21 -0.931 . . . . 0.0 111.875 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.401 ' CD2' HG21 ' A' ' 14' ' ' THR . 48.2 m-70 -112.03 98.47 7.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.744 -1.223 . . . . 0.0 110.33 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.36 71.06 9.42 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.232 -0.918 . . . . 0.0 110.429 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -110.33 179.87 0.76 Allowed Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.085 -1.009 . . . . 0.0 109.908 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.81 -30.13 11.76 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.303 1.159 . . . . 0.0 111.421 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.4 t -89.84 -40.88 12.15 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.929 -1.107 . . . . 0.0 110.088 179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.8 t -58.67 -50.52 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.123 -0.986 . . . . 0.0 109.759 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -57.56 -51.58 68.88 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.098 -1.001 . . . . 0.0 109.628 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -62.1 -41.09 97.86 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.828 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.4 m -54.83 -42.97 72.56 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.137 -0.977 . . . . 0.0 108.552 178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.37 -36.12 81.27 Favored 'General case' 0 N--CA 1.503 2.215 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.161 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -99.4 44.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.121 -0.987 . . . . 0.0 110.573 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.55 38.19 3.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.106 -0.996 . . . . 0.0 110.137 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.1 127.28 3.06 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -54.41 -28.29 42.72 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.209 -1.171 . . . . 0.0 110.338 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -60.66 -32.18 71.38 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.994 -1.066 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -49.8 -37.14 28.88 Favored 'General case' 0 N--CA 1.518 2.939 0 O-C-N 120.884 -1.135 . . . . 0.0 110.914 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -61.83 -55.62 27.94 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.11 -0.994 . . . . 0.0 109.23 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.63 -38.83 82.43 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.189 -0.944 . . . . 0.0 109.193 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -55.95 -37.27 68.77 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.153 -0.967 . . . . 0.0 110.13 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 75.8 t -56.15 -35.26 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 121.021 -1.049 . . . . 0.0 110.186 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 35.7 tttt -53.38 -41.51 65.98 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.875 -1.14 . . . . 0.0 109.93 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.4 -29.32 65.96 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -70.92 -52.26 21.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.876 -1.14 . . . . 0.0 110.321 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.9 p90 -99.61 33.79 2.41 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.013 -1.055 . . . . 0.0 111.406 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -79.86 -38.15 33.4 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.754 -1.216 . . . . 0.0 110.171 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -116.5 26.36 9.94 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.244 -0.91 . . . . 0.0 111.372 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.0 t90 -56.09 -43.14 77.75 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.873 -1.142 . . . . 0.0 110.218 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.469 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 19.8 ptp -152.75 38.59 0.53 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.156 -0.965 . . . . 0.0 110.74 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 51.31 39.74 24.73 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.02 -1.05 . . . . 0.0 110.965 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -144.43 -165.63 2.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.155 -0.966 . . . . 0.0 110.304 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -117.29 123.98 47.88 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.221 -0.924 . . . . 0.0 110.253 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.404 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -129.91 79.04 1.88 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.413 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 4.1 tt0 -109.34 36.33 2.96 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.11 -0.994 . . . . 0.0 110.463 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.4 t -114.65 -54.98 2.53 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.124 -0.985 . . . . 0.0 109.793 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -22.46 60.74 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 111.479 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 HG13 ' CE2' ' A' ' 38' ' ' TYR . 42.3 mm -65.15 -51.38 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 O-C-N 120.648 -1.282 . . . . 0.0 109.367 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -39.27 72.17 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.104 -0.997 . . . . 0.0 110.406 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -62.98 -36.01 82.09 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.211 -0.93 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.0 m -90.12 -38.72 13.33 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.069 -1.019 . . . . 0.0 110.16 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 61.6 p -68.07 -36.19 79.42 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.136 -0.977 . . . . 0.0 110.227 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.03 -43.78 9.72 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.045 -1.034 . . . . 0.0 110.112 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.57 53.7 1.49 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.064 -1.023 . . . . 0.0 110.435 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -91.53 -57.86 2.62 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.232 -0.918 . . . . 0.0 110.107 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -150.78 -57.83 0.17 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -0.977 . . . . 0.0 110.519 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -128.58 68.09 1.38 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.166 -0.959 . . . . 0.0 110.178 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -127.02 63.43 0.6 Allowed Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.073 -1.251 . . . . 0.0 110.69 -179.98 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 tpp . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.99 166.34 30.31 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.417 1.22 . . . . 0.0 110.347 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.9 122.24 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.208 -0.933 . . . . 0.0 110.754 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 52.7 t80 -104.64 156.43 17.98 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.998 -1.064 . . . . 0.0 110.038 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -127.46 137.41 52.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.149 -0.969 . . . . 0.0 110.412 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.35 97.98 6.65 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -54.77 -36.36 64.79 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.056 -1.027 . . . . 0.0 110.284 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.42 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.3 m-85 -60.26 -32.84 71.55 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.029 -1.045 . . . . 0.0 110.111 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.9 m -95.79 -1.41 49.75 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.037 -1.04 . . . . 0.0 112.033 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t0 52.39 39.02 26.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.428 -1.42 . . . . 0.0 110.574 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -146.4 171.86 14.38 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.203 -0.936 . . . . 0.0 110.098 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -120.44 122.61 41.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.15 -179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 mp -71.34 170.72 12.55 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.174 -0.954 . . . . 0.0 109.826 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.3 t -100.22 -29.89 12.21 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.296 -0.877 . . . . 0.0 111.767 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 m-70 -113.25 147.66 37.1 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.696 -1.252 . . . . 0.0 110.404 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -123.62 94.58 4.28 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.28 -0.888 . . . . 0.0 109.9 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.418 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.12 177.67 1.72 Allowed Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.258 -0.901 . . . . 0.0 110.212 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.418 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.4 Cg_endo -70.97 -31.94 14.34 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 O-C-N 123.435 1.229 . . . . 0.0 110.933 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -89.28 -39.62 13.36 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.014 -1.054 . . . . 0.0 110.073 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.43 -46.54 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.067 -1.021 . . . . 0.0 109.692 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 15.3 mtp180 -60.55 -49.46 77.47 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.084 -1.01 . . . . 0.0 109.574 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttt -62.28 -41.15 98.24 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.891 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.2 m -54.58 -42.28 70.87 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.087 -1.008 . . . . 0.0 108.442 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.35 -35.26 79.79 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.394 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -100.18 43.54 1.05 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.123 -0.985 . . . . 0.0 110.56 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -114.93 40.39 2.64 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.09 -1.006 . . . . 0.0 109.824 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -131.38 157.04 22.13 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 ttm-85 -85.51 -10.13 56.45 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.254 -1.145 . . . . 0.0 111.026 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -90.53 -26.01 19.95 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.691 -1.255 . . . . 0.0 111.11 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.0 t-80 -49.76 -38.88 35.74 Favored 'General case' 0 N--CA 1.517 2.916 0 O-C-N 120.814 -1.179 . . . . 0.0 110.574 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -64.58 -53.72 43.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.816 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.09 -39.97 91.94 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.196 -0.94 . . . . 0.0 108.999 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -56.53 -37.88 71.08 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.205 -0.935 . . . . 0.0 110.031 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.42 HG12 ' CE1' ' A' ' 8' ' ' TYR . 93.5 t -57.66 -33.73 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.125 -0.984 . . . . 0.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.0 tttt -52.24 -42.26 63.45 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.87 -1.144 . . . . 0.0 109.849 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.08 -29.53 63.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.336 -0.852 . . . . 0.0 110.375 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -69.38 -52.02 31.08 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.942 -1.099 . . . . 0.0 110.319 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.7 p90 -99.72 35.0 2.1 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.077 -1.014 . . . . 0.0 111.382 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -88.11 -38.34 15.47 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.807 -1.183 . . . . 0.0 109.884 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -112.91 31.58 6.3 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 110.765 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -92.85 -41.7 9.93 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.142 -0.974 . . . . 0.0 110.026 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.445 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -154.95 -65.76 0.13 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.14 -0.975 . . . . 0.0 110.599 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -126.57 -171.55 2.43 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.965 . . . . 0.0 110.005 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.25 38.81 3.44 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.1 -1.0 . . . . 0.0 110.342 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -152.96 75.23 1.08 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.237 -0.914 . . . . 0.0 110.484 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.419 ' HB1' ' CD2' ' A' ' 38' ' ' TYR . . . -136.55 75.43 1.54 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.199 -0.938 . . . . 0.0 110.224 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -111.36 35.86 3.44 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.095 -1.003 . . . . 0.0 110.435 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.54 -55.47 2.5 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.201 -0.937 . . . . 0.0 109.24 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.98 64.51 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.307 -0.871 . . . . 0.0 111.189 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.6 -40.27 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.62 -1.3 . . . . 0.0 109.618 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.422 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 10.5 t0 -72.76 -39.83 66.5 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.128 -0.983 . . . . 0.0 110.013 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -57.02 -36.22 70.18 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.179 -0.951 . . . . 0.0 110.63 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 90.0 m -90.53 -46.69 8.16 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.422 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 60.0 p -59.71 -35.48 74.6 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.329 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.61 -39.56 12.43 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.073 -1.017 . . . . 0.0 110.391 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.22 47.23 1.03 Allowed 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.111 -0.993 . . . . 0.0 110.736 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -92.61 -40.25 10.87 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.112 -0.993 . . . . 0.0 110.107 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -115.25 41.03 2.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.14 -0.975 . . . . 0.0 110.165 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -129.73 71.52 1.45 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.225 -0.922 . . . . 0.0 110.135 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.29 -78.23 1.38 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.493 1.701 0 O-C-N 121.226 -1.161 . . . . 0.0 110.251 -179.998 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 ttt . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.09 155.06 57.36 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.391 1.206 . . . . 0.0 110.555 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -136.43 149.8 48.43 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.194 -0.941 . . . . 0.0 110.06 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CE1' ' NH2' ' A' ' 21' ' ' ARG . 43.5 t80 -114.36 156.36 24.58 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.244 -0.91 . . . . 0.0 110.01 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -135.43 136.79 41.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.399 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -112.27 95.39 5.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.209 -0.932 . . . . 0.0 110.222 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.94 -36.16 59.55 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 121.026 -1.046 . . . . 0.0 110.383 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CE1' HG12 ' A' ' 34' ' ' VAL . 90.1 m-85 -60.45 -32.18 71.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.149 -0.97 . . . . 0.0 110.067 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -97.66 -1.54 43.41 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.064 -1.023 . . . . 0.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.92 38.51 27.16 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.377 -1.452 . . . . 0.0 110.567 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -139.5 173.07 11.92 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.162 -0.961 . . . . 0.0 109.964 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.96 119.53 30.69 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.279 -0.888 . . . . 0.0 110.254 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 mp -78.1 163.98 25.39 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.11 -0.994 . . . . 0.0 109.383 179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 t -101.05 -21.79 14.91 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.132 -0.98 . . . . 0.0 112.166 -179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -120.53 139.6 52.67 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.628 -1.295 . . . . 0.0 110.145 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -120.6 93.19 3.96 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.253 -0.904 . . . . 0.0 109.78 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -139.51 178.39 1.65 Allowed Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.321 -0.862 . . . . 0.0 109.993 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.62 -26.82 23.09 Favored 'Trans proline' 0 C--N 1.315 -1.196 0 O-C-N 123.351 1.185 . . . . 0.0 111.308 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.08 -40.71 9.92 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.893 -1.129 . . . . 0.0 110.16 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 83.9 t -60.12 -48.39 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.031 -1.043 . . . . 0.0 109.884 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.421 ' NH2' ' CE1' ' A' ' 4' ' ' PHE . 19.6 mtp180 -56.99 -51.69 68.22 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.132 -0.98 . . . . 0.0 109.86 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -60.18 -40.55 90.38 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.179 -0.95 . . . . 0.0 109.048 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 42.1 m -54.69 -42.92 72.03 Favored 'General case' 0 N--CA 1.513 2.675 0 O-C-N 121.035 -1.041 . . . . 0.0 108.369 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -63.73 -38.61 91.76 Favored 'General case' 0 N--CA 1.502 2.175 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.004 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.02 51.93 1.27 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.298 -0.876 . . . . 0.0 110.488 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 37.69 3.82 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.06 -1.025 . . . . 0.0 110.327 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.68 122.8 1.75 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -50.87 -30.26 14.09 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.118 -1.225 . . . . 0.0 110.847 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -33.16 69.6 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.095 -1.003 . . . . 0.0 110.503 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -50.06 -38.28 37.37 Favored 'General case' 0 N--CA 1.517 2.887 0 O-C-N 121.016 -1.053 . . . . 0.0 110.694 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -62.55 -53.17 58.71 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.161 -0.962 . . . . 0.0 108.972 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -60.61 -39.66 89.01 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.221 -0.924 . . . . 0.0 109.0 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.13 -38.43 68.21 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.207 -0.933 . . . . 0.0 110.099 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG12 ' CE1' ' A' ' 8' ' ' TYR . 74.6 t -59.27 -37.9 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 109.894 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 1.5 tppp? -56.99 -41.79 79.06 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.973 -1.08 . . . . 0.0 109.509 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.27 -29.81 67.84 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.251 -0.905 . . . . 0.0 110.101 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -68.54 -52.53 30.97 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.957 -1.089 . . . . 0.0 110.28 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.1 p90 -98.53 24.82 6.97 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.085 -1.01 . . . . 0.0 111.82 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -65.34 -41.23 94.11 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 120.626 -1.296 . . . . 0.0 109.745 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 mtmt -122.63 26.3 8.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.35 -0.844 . . . . 0.0 111.164 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.0 t90 -64.4 -40.6 96.11 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.888 -1.133 . . . . 0.0 110.219 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.449 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 mtm -156.29 -56.53 0.09 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.138 -0.976 . . . . 0.0 110.845 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -126.08 -171.84 2.48 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.138 -0.976 . . . . 0.0 110.532 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -34.19 11.25 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.158 -0.964 . . . . 0.0 111.015 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -93.32 96.17 9.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.927 -1.108 . . . . 0.0 110.189 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -141.48 71.21 1.35 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -121.18 34.14 5.31 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.21 -0.931 . . . . 0.0 110.635 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -106.76 -51.48 2.93 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.125 -0.984 . . . . 0.0 109.558 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -21.14 62.73 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.215 -0.928 . . . . 0.0 111.499 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.469 HD11 HG22 ' A' ' 50' ' ' ILE . 49.9 mm -77.85 -56.3 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 O-C-N 120.665 -1.272 . . . . 0.0 109.77 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.34 -36.71 71.51 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -73.01 -34.04 66.13 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.647 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.6 m -87.7 -39.69 14.76 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.939 -1.101 . . . . 0.0 110.163 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 10.3 p -55.94 -36.14 67.44 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.514 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.1 -38.35 31.83 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.131 -0.981 . . . . 0.0 110.089 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.89 59.39 3.18 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.096 -1.003 . . . . 0.0 109.923 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -92.03 -41.52 10.48 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.327 -0.858 . . . . 0.0 110.103 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -139.88 40.1 1.99 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.149 -0.969 . . . . 0.0 110.286 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -145.29 81.44 1.63 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.224 -0.923 . . . . 0.0 110.374 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -136.04 44.5 1.16 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt . . . . . 0 N--CA 1.496 1.836 0 O-C-N 121.17 -1.194 . . . . 0.0 110.245 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 ptp . . . . . 0 N--CA 1.499 1.99 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.05 103.15 1.44 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.277 1.146 . . . . 0.0 110.319 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 35.0 mmtm -127.0 145.14 50.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.112 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.451 ' CD2' ' NH1' ' A' ' 21' ' ' ARG . 76.9 t80 -116.26 161.95 18.23 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -132.72 136.15 46.21 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.237 -0.915 . . . . 0.0 110.212 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.39 97.24 6.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.199 -0.938 . . . . 0.0 109.905 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -51.39 -35.57 39.47 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.121 -0.987 . . . . 0.0 110.554 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.428 ' CD1' HG12 ' A' ' 34' ' ' VAL . 92.3 m-85 -62.7 -30.8 71.68 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.145 -0.972 . . . . 0.0 110.249 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.3 m -100.02 -8.98 23.2 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.952 -1.093 . . . . 0.0 112.118 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.95 42.44 31.06 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.391 -1.443 . . . . 0.0 110.087 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -145.35 172.43 13.17 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.289 -0.882 . . . . 0.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 3.5 t80 -118.29 129.49 55.49 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.255 -0.903 . . . . 0.0 110.305 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 mp -85.9 170.2 12.58 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.173 -0.955 . . . . 0.0 109.861 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.0 t -97.26 -21.96 16.96 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.198 -0.939 . . . . 0.0 111.696 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -122.16 147.29 46.34 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.619 -1.301 . . . . 0.0 110.097 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -127.08 93.54 3.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.208 -0.933 . . . . 0.0 109.81 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -148.19 179.1 1.25 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.284 -0.885 . . . . 0.0 110.17 -179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.03 -32.09 13.9 Favored 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.326 1.171 . . . . 0.0 110.811 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.7 OUTLIER -85.54 -39.72 17.1 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.975 -1.078 . . . . 0.0 109.956 179.373 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.5 t -64.9 -47.12 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 O-C-N 121.11 -0.993 . . . . 0.0 109.678 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.451 ' NH1' ' CD2' ' A' ' 4' ' ' PHE . 11.7 mtp180 -57.61 -51.96 67.39 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.072 -1.017 . . . . 0.0 109.588 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -60.77 -40.36 92.23 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.184 -0.948 . . . . 0.0 108.82 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.5 m -55.18 -43.38 74.3 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.141 -0.975 . . . . 0.0 108.546 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.8 t60 -61.69 -37.29 83.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.426 -0.796 . . . . 0.0 109.061 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.25 50.06 1.07 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.187 -0.946 . . . . 0.0 110.369 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.71 37.63 3.88 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.051 -1.031 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.68 128.44 3.35 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.2 tpp85 -54.47 -28.52 45.15 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.141 -1.211 . . . . 0.0 110.413 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -59.5 -35.77 74.79 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.977 -1.077 . . . . 0.0 110.355 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.78 -46.09 64.03 Favored 'General case' 0 N--CA 1.514 2.725 0 O-C-N 120.931 -1.106 . . . . 0.0 110.489 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -54.57 45.59 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.086 -1.009 . . . . 0.0 109.427 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -60.09 -39.47 86.23 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.186 -0.946 . . . . 0.0 109.073 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -56.85 -38.67 73.0 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.948 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.428 HG12 ' CD1' ' A' ' 8' ' ' TYR . 65.9 t -59.06 -38.21 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.554 0 O-C-N 121.139 -0.976 . . . . 0.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 29.3 ttmt -54.97 -40.58 70.16 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.949 -1.095 . . . . 0.0 109.832 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -58.11 -30.16 66.06 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.304 -0.873 . . . . 0.0 110.229 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.24 -53.51 24.15 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.931 -1.106 . . . . 0.0 110.177 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -98.14 22.79 9.01 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.137 -0.977 . . . . 0.0 111.702 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.78 -38.4 90.47 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.593 -1.317 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -113.89 33.28 5.3 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.157 -0.964 . . . . 0.0 110.742 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.5 t90 -92.16 -40.51 10.97 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.19 -0.944 . . . . 0.0 110.151 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.434 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 ttm -151.78 -62.98 0.17 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.17 -0.956 . . . . 0.0 110.664 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -122.24 -172.9 2.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.0 110.524 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -98.32 -37.35 9.68 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.225 -0.922 . . . . 0.0 110.783 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -105.47 92.81 4.35 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.092 -1.005 . . . . 0.0 110.219 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.52 74.85 1.59 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -0.919 . . . . 0.0 110.13 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.16 35.54 3.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.099 -1.001 . . . . 0.0 110.492 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.0 t -110.5 -54.64 2.56 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.096 -1.002 . . . . 0.0 109.395 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -20.7 64.34 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.25 -0.906 . . . . 0.0 111.393 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.6 mm -72.33 -44.91 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 120.681 -1.262 . . . . 0.0 109.788 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -62.79 -48.59 78.48 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.168 -0.957 . . . . 0.0 109.887 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -56.52 -33.48 66.08 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.143 -0.973 . . . . 0.0 110.632 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.3 m -89.93 -37.04 14.66 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.945 -1.097 . . . . 0.0 110.351 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.8 p -74.42 -35.02 63.38 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.037 -1.04 . . . . 0.0 110.543 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -87.36 -34.67 18.73 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.042 -1.036 . . . . 0.0 110.633 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.87 36.87 1.47 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.945 -1.097 . . . . 0.0 111.343 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -91.51 -45.07 8.72 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.997 -1.064 . . . . 0.0 110.116 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.51 73.8 1.52 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.117 -0.99 . . . . 0.0 110.137 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -116.5 -58.37 2.09 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.177 -0.952 . . . . 0.0 110.255 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -118.99 -103.55 2.1 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.2 mttp . . . . . 0 N--CA 1.494 1.732 0 O-C-N 121.113 -1.228 . . . . 0.0 110.167 179.956 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.57 148.31 47.45 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 O-C-N 123.361 1.19 . . . . 0.0 110.474 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -135.56 156.42 48.91 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.18 -0.95 . . . . 0.0 110.216 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.441 ' CD2' ' N ' ' A' ' 5' ' ' TYR . 58.8 t80 -110.4 161.65 15.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.103 -0.998 . . . . 0.0 110.522 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD2' ' A' ' 4' ' ' PHE . 34.9 t80 -133.7 134.06 42.62 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.252 -0.905 . . . . 0.0 110.115 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.9 t -113.53 96.39 5.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -0.975 . . . . 0.0 110.177 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -53.71 -36.34 62.13 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.388 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.432 ' CE2' HG12 ' A' ' 34' ' ' VAL . 83.6 m-85 -60.74 -32.4 71.67 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.091 -1.006 . . . . 0.0 110.156 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.5 m -96.99 -5.94 36.62 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.076 -1.015 . . . . 0.0 112.116 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 54.75 39.98 31.67 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.349 -1.47 . . . . 0.0 110.23 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -143.42 172.24 13.05 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.236 -0.915 . . . . 0.0 109.918 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -117.34 138.82 51.53 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.271 -0.893 . . . . 0.0 110.469 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -97.68 168.42 10.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.222 -0.924 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.416 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -99.38 -29.07 12.98 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.217 -0.927 . . . . 0.0 111.73 -179.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.416 ' CD2' HG21 ' A' ' 14' ' ' THR . 54.6 m-70 -112.06 148.42 33.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.774 -1.204 . . . . 0.0 110.431 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -126.92 93.93 3.89 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.331 -0.856 . . . . 0.0 109.761 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.422 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -150.82 178.52 1.49 Allowed Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.272 -0.893 . . . . 0.0 110.305 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.07 -33.3 11.94 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.354 1.186 . . . . 0.0 110.735 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 23' ' ' THR . 2.7 t -83.16 -38.59 22.15 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.011 -1.056 . . . . 0.0 110.033 179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.2 t -64.1 -47.38 90.43 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.416 ' HB3' ' CE1' ' A' ' 57' ' ' PHE . 36.3 mtp180 -57.97 -50.07 74.62 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.097 -1.002 . . . . 0.0 109.53 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.12 -40.99 97.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.214 -0.929 . . . . 0.0 108.655 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' SER . 96.5 m -55.48 -43.84 75.92 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.159 -0.963 . . . . 0.0 108.487 178.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -62.59 -39.49 93.88 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.353 -0.842 . . . . 0.0 108.863 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.5 t -92.42 56.0 2.65 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.278 -0.889 . . . . 0.0 110.335 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -118.5 37.42 4.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.127 -0.983 . . . . 0.0 110.414 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.15 128.27 3.23 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -54.54 -28.18 43.7 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.153 -1.204 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.941 -1.1 . . . . 0.0 110.522 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -51.47 -40.66 59.92 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.951 -1.093 . . . . 0.0 110.523 -179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.2 tttt -62.75 -55.61 25.03 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.196 -0.94 . . . . 0.0 109.064 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -59.34 -38.85 81.38 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.2 -0.938 . . . . 0.0 109.189 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.62 -38.23 71.81 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.432 HG12 ' CE2' ' A' ' 8' ' ' TYR . 79.5 t -64.46 -39.57 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 O-C-N 121.134 -0.978 . . . . 0.0 109.641 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.3 ttpt -58.38 -42.79 87.86 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.069 -1.019 . . . . 0.0 109.348 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.02 -30.2 67.84 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.529 -0.869 . . . . 0.0 110.283 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -70.41 -51.82 26.81 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.901 -1.125 . . . . 0.0 110.322 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.438 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 40.3 p90 -100.03 34.54 2.28 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.13 -0.981 . . . . 0.0 111.295 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -78.3 -39.63 39.2 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.814 -1.179 . . . . 0.0 110.0 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tttm -117.82 22.69 12.15 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.243 -0.91 . . . . 0.0 111.53 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 13.1 t90 -57.61 -55.29 36.75 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.796 -1.19 . . . . 0.0 110.151 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.457 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 13.2 mtt -149.1 -63.1 0.23 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -122.79 -171.95 2.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.161 -0.962 . . . . 0.0 110.06 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -110.76 39.72 2.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.227 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -145.55 75.02 1.41 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.917 . . . . 0.0 110.174 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.46 71.73 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.239 -0.913 . . . . 0.0 110.343 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.76 34.71 5.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.254 -0.904 . . . . 0.0 110.574 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 7.2 p -108.12 -52.57 2.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.056 -1.027 . . . . 0.0 109.418 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.408 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -60.92 -21.12 63.08 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.195 -0.941 . . . . 0.0 111.418 179.376 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.422 HG21 HD11 ' A' ' 50' ' ' ILE . 49.5 mm -76.12 -52.22 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.659 -1.276 . . . . 0.0 109.597 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.417 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 26.1 t0 -58.45 -39.39 79.72 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.2 -0.937 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -55.88 -36.34 67.49 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.076 -1.015 . . . . 0.0 110.625 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.1 m -91.69 -45.9 8.2 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.08 -1.013 . . . . 0.0 110.172 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.417 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 77.1 p -62.02 -39.69 93.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.188 -0.945 . . . . 0.0 110.042 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.19 -44.81 92.22 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.123 -0.986 . . . . 0.0 110.155 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.96 -37.12 73.59 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.124 -0.985 . . . . 0.0 110.507 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.416 ' CE1' ' HB3' ' A' ' 21' ' ' ARG . 7.0 m-85 -58.86 -38.94 79.89 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.05 -1.031 . . . . 0.0 110.462 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -130.4 -58.44 1.05 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.19 44.3 25.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.932 -1.105 . . . . 0.0 110.306 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -130.84 43.31 1.31 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.134 0 O-C-N 121.07 -1.253 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 CA-C-O 119.845 -0.121 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -79.28 102.96 1.56 Allowed 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.079 1.041 . . . . 0.0 110.347 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -137.73 158.11 45.06 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.072 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -115.65 162.06 17.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.112 -0.993 . . . . 0.0 110.089 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -136.18 132.83 36.47 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.202 -0.936 . . . . 0.0 110.187 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.1 t -112.44 94.1 4.76 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.085 -1.009 . . . . 0.0 110.051 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -52.06 -35.98 49.13 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.074 -1.016 . . . . 0.0 110.518 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CE1' HG12 ' A' ' 34' ' ' VAL . 83.5 m-85 -61.07 -32.8 72.44 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.18 -0.95 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.5 m -97.47 -4.08 38.76 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.001 -1.062 . . . . 0.0 112.261 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 53.54 38.99 29.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.446 -1.409 . . . . 0.0 110.479 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -140.68 170.33 15.98 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.904 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.11 137.08 53.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -95.12 163.98 13.06 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.7 t -100.41 -31.65 11.2 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.041 -1.037 . . . . 0.0 111.724 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.5 m-70 -114.61 132.96 56.18 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.718 -1.239 . . . . 0.0 110.194 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.84 95.94 5.69 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.257 -0.902 . . . . 0.0 109.809 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -141.58 179.37 1.24 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.2 -0.937 . . . . 0.0 109.966 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.17 -28.04 19.25 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.314 1.165 . . . . 0.0 111.176 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.401 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -90.88 -41.94 10.89 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.901 -1.125 . . . . 0.0 109.974 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.1 t -60.92 -50.96 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.524 0 O-C-N 121.178 -0.951 . . . . 0.0 109.66 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -57.09 -51.11 70.61 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.125 -0.984 . . . . 0.0 109.607 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -61.33 -40.57 94.7 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.797 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 19' ' ' SER . 92.5 m -54.77 -43.56 72.87 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.121 -0.987 . . . . 0.0 108.443 178.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -63.47 -39.72 95.21 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.08 52.12 1.27 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -117.83 37.63 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.154 -0.966 . . . . 0.0 110.347 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.67 127.28 2.68 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.944 -1.263 . . . . 0.0 109.944 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -54.37 -28.69 44.87 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.033 -1.275 . . . . 0.0 110.169 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -58.46 -33.87 70.23 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 120.99 -1.068 . . . . 0.0 110.464 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -50.47 -38.71 45.35 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.925 -1.109 . . . . 0.0 110.75 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -63.16 -54.28 40.08 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.104 -0.998 . . . . 0.0 108.945 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -60.13 -38.98 84.69 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.11 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.11 -38.33 70.61 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.24 -0.913 . . . . 0.0 110.117 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CE1' ' A' ' 8' ' ' TYR . 73.5 t -59.14 -37.32 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.062 -1.024 . . . . 0.0 109.879 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.3 ttpp -53.41 -39.97 64.73 Favored 'General case' 0 N--CA 1.513 2.724 0 O-C-N 120.887 -1.133 . . . . 0.0 109.845 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -58.47 -30.79 67.25 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.293 -0.879 . . . . 0.0 110.222 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -68.05 -53.26 27.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.984 -1.072 . . . . 0.0 109.967 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.7 p90 -100.08 33.29 2.66 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.097 -1.002 . . . . 0.0 111.248 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -73.62 -39.11 64.8 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.771 -1.205 . . . . 0.0 110.112 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -110.16 32.35 5.2 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.553 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.444 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.7 t90 -107.27 -57.9 2.02 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.152 -0.968 . . . . 0.0 110.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.444 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 ttm -140.5 63.08 1.48 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.271 -0.893 . . . . 0.0 109.627 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -45.17 -34.15 2.59 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.363 -0.836 . . . . 0.0 111.587 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -81.35 129.41 34.61 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.042 -1.036 . . . . 0.0 109.32 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 54.71 71.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.976 -1.078 . . . . 0.0 110.213 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -131.25 -174.02 3.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.362 -0.836 . . . . 0.0 110.445 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.429 ' CG ' ' OH ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 56.76 34.03 23.95 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.346 -0.846 . . . . 0.0 110.542 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.96 -56.57 2.31 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.11 -0.993 . . . . 0.0 109.368 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -22.2 62.12 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.223 -0.923 . . . . 0.0 111.213 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.5 mm -64.13 -42.78 96.66 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 120.702 -1.249 . . . . 0.0 108.991 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.73 -37.25 73.25 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.335 -0.853 . . . . 0.0 110.391 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -72.1 -34.55 68.73 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.617 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.4 m -83.73 -40.44 18.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.006 -1.059 . . . . 0.0 110.167 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.9 p -59.8 -37.57 79.51 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.121 -0.987 . . . . 0.0 110.176 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.02 -40.18 20.28 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.082 -1.011 . . . . 0.0 109.865 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.09 -34.77 66.32 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.164 -0.96 . . . . 0.0 110.492 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -91.95 11.89 23.56 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.085 -1.01 . . . . 0.0 111.989 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -114.16 -55.69 2.47 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.565 -1.334 . . . . 0.0 110.203 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -115.01 -56.32 2.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.198 -0.938 . . . . 0.0 110.163 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 125.75 -62.27 0.6 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.8 ttmt . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.214 -1.168 . . . . 0.0 110.184 -179.954 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ttt . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.87 171.11 18.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.41 1.216 . . . . 0.0 110.439 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 mttt 55.56 169.94 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.365 -0.834 . . . . 0.0 110.844 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.401 ' CD2' ' OD1' ' A' ' 16' ' ' ASP . 77.5 t80 -125.57 162.45 24.91 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.128 -0.982 . . . . 0.0 110.137 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -131.91 135.71 46.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.226 -0.921 . . . . 0.0 110.535 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -112.79 95.55 5.48 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.175 -0.953 . . . . 0.0 109.731 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.85 -35.24 31.51 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.16 -0.962 . . . . 0.0 110.725 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 74.3 m-85 -63.54 -30.64 71.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.094 -1.004 . . . . 0.0 110.155 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.6 m -100.01 -8.83 23.38 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.968 -1.082 . . . . 0.0 112.107 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 t0 55.91 40.64 30.5 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.368 -1.458 . . . . 0.0 110.121 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.04 173.64 11.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.313 -0.867 . . . . 0.0 109.957 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -120.64 131.13 54.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.685 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mp -88.42 172.04 9.67 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.239 -0.913 . . . . 0.0 109.567 179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.42 HG21 ' CG ' ' A' ' 15' ' ' HIS . 15.0 t -98.3 -31.93 11.8 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.148 -0.97 . . . . 0.0 111.469 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.42 ' CG ' HG21 ' A' ' 14' ' ' THR . 28.1 m-70 -121.04 134.65 55.29 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.807 -1.183 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.401 ' OD1' ' CD2' ' A' ' 4' ' ' PHE . 24.0 t0 -113.06 97.27 6.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.149 -0.97 . . . . 0.0 109.895 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -144.34 179.4 1.18 Allowed Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.225 -0.922 . . . . 0.0 110.015 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.19 -31.32 14.69 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.303 1.16 . . . . 0.0 110.853 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.8 t -86.16 -38.97 17.15 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.923 -1.11 . . . . 0.0 110.069 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 80.7 t -67.61 -46.35 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.119 -0.988 . . . . 0.0 109.751 179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.0 mtp180 -56.92 -52.34 65.57 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.054 -1.028 . . . . 0.0 109.757 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -60.67 -40.19 91.21 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.156 -0.965 . . . . 0.0 108.871 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.6 m -55.09 -43.37 73.89 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.101 -0.999 . . . . 0.0 108.515 178.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -62.29 -38.48 89.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.396 -0.815 . . . . 0.0 109.004 178.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -94.92 52.81 1.51 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.22 -0.925 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -117.66 39.47 3.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 109.899 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -132.78 160.11 23.71 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -88.32 -10.99 47.64 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.334 -1.098 . . . . 0.0 110.83 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtpp -91.14 -24.35 19.99 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.582 -1.324 . . . . 0.0 111.212 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -48.9 -38.51 22.86 Favored 'General case' 0 N--CA 1.517 2.897 0 O-C-N 120.813 -1.179 . . . . 0.0 110.813 -179.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -64.94 -54.41 31.04 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.24 -0.984 . . . . 0.0 108.906 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.03 -39.26 89.13 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.229 -0.92 . . . . 0.0 109.073 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -56.98 -37.18 71.27 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.13 -0.981 . . . . 0.0 110.021 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 71.8 t -55.85 -37.98 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 O-C-N 120.975 -1.078 . . . . 0.0 110.079 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.0 tttt -58.98 -42.96 91.21 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.057 -1.027 . . . . 0.0 109.293 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -59.35 -26.3 64.93 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.467 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -74.43 -51.92 13.54 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.875 -1.141 . . . . 0.0 110.426 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 34.4 p90 -99.41 31.98 2.93 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.057 -1.027 . . . . 0.0 111.495 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -76.16 -40.25 52.98 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.724 -1.235 . . . . 0.0 110.131 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mttp -84.65 -32.04 23.86 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.248 -0.908 . . . . 0.0 110.182 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 5.9 t90 -50.21 -45.31 53.63 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.971 -1.081 . . . . 0.0 111.058 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.468 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -114.72 -55.3 2.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 110.341 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 53.65 38.34 28.1 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.978 -1.076 . . . . 0.0 110.739 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -157.55 -56.66 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.183 -0.948 . . . . 0.0 110.761 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -164.18 82.77 0.42 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.165 -0.959 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -138.77 72.53 1.41 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.29 36.63 4.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.259 -0.901 . . . . 0.0 110.277 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.39 -53.85 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.148 -0.97 . . . . 0.0 109.745 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.37 -21.41 62.1 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.255 -0.903 . . . . 0.0 111.522 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.414 HD13 ' CE2' ' A' ' 38' ' ' TYR . 47.6 mm -71.75 -50.68 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 O-C-N 120.608 -1.308 . . . . 0.0 109.521 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -64.86 -39.39 93.48 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.274 -0.891 . . . . 0.0 109.915 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -33.43 64.26 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.095 -1.003 . . . . 0.0 110.731 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.1 m -90.13 -35.78 15.21 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 120.968 -1.083 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 69.1 p -79.96 -37.46 34.36 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.014 -1.054 . . . . 0.0 110.294 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.11 -39.87 40.0 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.065 -1.022 . . . . 0.0 109.812 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -50.49 -31.11 14.43 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.087 -1.008 . . . . 0.0 111.18 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -82.67 -39.0 22.66 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.951 -1.093 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.02 77.95 1.66 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.065 -1.022 . . . . 0.0 110.577 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -163.61 42.16 0.1 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.154 -0.966 . . . . 0.0 110.882 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 137.28 -61.28 0.6 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.3 tttm . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.19 -1.183 . . . . 0.0 110.209 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mtt . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 92.18 0.8 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.417 1.22 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.4 mttt -133.79 146.07 50.35 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.221 -0.924 . . . . 0.0 110.175 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 75.2 t80 -108.04 161.45 14.94 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.28 -0.888 . . . . 0.0 110.164 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -135.05 137.45 42.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.283 -0.886 . . . . 0.0 110.002 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.7 t -119.26 96.91 5.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.101 -0.999 . . . . 0.0 110.294 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.87 -35.9 62.05 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.053 -1.029 . . . . 0.0 110.293 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.6 m-85 -60.59 -32.89 71.98 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.122 -0.986 . . . . 0.0 110.117 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.2 m -97.34 -4.37 38.69 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.061 -1.025 . . . . 0.0 112.198 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 53.45 39.4 29.9 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.376 -1.452 . . . . 0.0 110.573 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.76 170.06 16.4 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.294 -0.879 . . . . 0.0 109.992 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -118.41 134.05 55.38 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.322 -0.861 . . . . 0.0 110.423 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -90.09 161.81 15.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.191 -0.943 . . . . 0.0 109.664 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.7 t -98.69 -21.95 16.16 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.101 -0.999 . . . . 0.0 111.888 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -115.28 143.94 44.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.635 -1.291 . . . . 0.0 110.11 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -125.78 92.29 3.57 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 109.715 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.57 178.57 1.45 Allowed Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.229 -0.919 . . . . 0.0 110.043 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -70.82 -28.67 19.84 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.438 1.23 . . . . 0.0 111.078 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.2 OUTLIER -91.61 -41.6 10.67 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.882 -1.136 . . . . 0.0 110.004 179.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 97.9 t -59.44 -54.05 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.093 -1.005 . . . . 0.0 109.728 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 20.4 mtp-105 -56.17 -50.52 70.95 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.163 -0.961 . . . . 0.0 109.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -61.99 -40.44 95.64 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.334 -0.946 . . . . 0.0 108.818 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 19' ' ' SER . 67.4 m -54.5 -43.07 71.49 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.117 -0.989 . . . . 0.0 108.368 178.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -62.45 -37.55 86.33 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.392 -0.818 . . . . 0.0 108.886 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -99.26 45.17 1.0 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.261 -0.899 . . . . 0.0 110.448 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -116.6 38.14 3.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.215 -0.928 . . . . 0.0 110.182 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.17 128.71 3.79 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.9 ttp85 -55.38 -27.49 47.87 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.225 -1.162 . . . . 0.0 110.545 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -62.53 -33.53 75.09 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.996 -1.065 . . . . 0.0 110.669 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -51.32 -39.0 56.0 Favored 'General case' 0 N--CA 1.516 2.851 0 O-C-N 120.877 -1.139 . . . . 0.0 110.508 -179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -63.21 -55.1 27.81 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.35 -0.94 . . . . 0.0 109.057 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.01 -39.52 86.1 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.211 -0.93 . . . . 0.0 109.111 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -56.6 -38.27 71.79 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.17 -0.956 . . . . 0.0 110.012 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE1' ' A' ' 8' ' ' TYR . 71.5 t -56.73 -35.01 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.121 -0.987 . . . . 0.0 110.123 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 33.6 tttt -53.32 -44.57 68.5 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.812 -1.18 . . . . 0.0 109.932 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.42 -28.89 65.67 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.282 -0.887 . . . . 0.0 110.407 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -74.31 -50.75 17.53 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.947 -1.096 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 37.9 p90 -99.31 34.42 2.18 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.029 -1.044 . . . . 0.0 111.451 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -90.97 -41.21 11.25 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.723 -1.235 . . . . 0.0 109.656 178.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -112.53 32.83 5.33 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.346 -0.846 . . . . 0.0 110.26 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 16.2 t90 -97.7 -41.87 7.89 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.185 -0.947 . . . . 0.0 110.439 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.462 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -115.69 -67.96 0.96 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.063 -1.023 . . . . 0.0 110.108 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -167.17 -60.66 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.15 -0.969 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.21 -51.52 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.074 -1.016 . . . . 0.0 111.093 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -81.12 89.0 5.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.111 -0.993 . . . . 0.0 110.3 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.401 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -145.78 69.42 1.22 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.236 -0.915 . . . . 0.0 110.136 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -122.32 35.38 4.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.552 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -108.16 -52.68 2.73 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.194 -0.941 . . . . 0.0 109.499 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -20.94 63.34 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 111.478 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.442 HG21 HD11 ' A' ' 50' ' ' ILE . 48.6 mm -74.77 -56.18 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 120.699 -1.251 . . . . 0.0 109.806 179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -56.97 -39.43 74.59 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.167 -0.958 . . . . 0.0 110.312 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -57.13 -36.47 70.73 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.117 -0.99 . . . . 0.0 110.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.0 m -91.25 -35.92 14.21 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.063 -1.023 . . . . 0.0 110.541 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 80.6 p -77.37 -39.88 45.77 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.022 -1.049 . . . . 0.0 110.137 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.75 -40.6 92.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.101 -0.999 . . . . 0.0 109.898 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.56 79.94 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.221 -0.925 . . . . 0.0 110.221 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -53.14 -37.17 61.6 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 121.054 -1.029 . . . . 0.0 110.731 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -113.33 66.6 0.66 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.088 -1.008 . . . . 0.0 110.15 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -116.43 -57.03 2.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.115 -0.991 . . . . 0.0 110.249 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 63.61 75.15 0.37 Allowed Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.1 tttp . . . . . 0 N--CA 1.493 1.697 0 O-C-N 121.173 -1.193 . . . . 0.0 110.247 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.2 mtt . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.55 131.39 17.35 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.469 1.247 . . . . 0.0 110.387 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.417 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 16.8 mtmt -141.82 148.56 39.06 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.196 -0.94 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -110.88 152.07 27.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.221 -0.924 . . . . 0.0 109.629 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -128.95 136.0 49.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.2 t -110.15 94.5 5.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 110.168 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -51.73 -35.57 43.72 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.051 -1.03 . . . . 0.0 110.459 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 78.3 m-85 -61.85 -32.2 72.51 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.174 -0.953 . . . . 0.0 110.057 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.4 m -98.29 -0.96 42.92 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.993 -1.067 . . . . 0.0 112.146 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 52.25 38.87 25.87 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.407 -1.433 . . . . 0.0 110.69 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -140.21 171.23 14.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 109.978 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.4 OUTLIER -122.1 119.14 30.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.205 -0.935 . . . . 0.0 110.145 -179.758 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -75.99 166.71 23.09 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.145 -0.972 . . . . 0.0 109.489 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.8 t -100.37 -30.38 11.88 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.153 -0.967 . . . . 0.0 111.725 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -112.44 142.18 45.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.732 -1.23 . . . . 0.0 110.154 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.41 89.71 3.18 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.184 -0.948 . . . . 0.0 109.714 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -136.59 178.44 1.74 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.847 . . . . 0.0 110.046 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.53 -29.94 19.46 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 23' ' ' THR . 67.8 m -90.32 -43.63 10.22 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.923 -1.11 . . . . 0.0 109.91 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t -59.58 -53.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.632 0 O-C-N 121.184 -0.948 . . . . 0.0 109.789 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 mtp-105 -56.76 -50.22 72.91 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.145 -0.972 . . . . 0.0 109.699 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -61.93 -40.29 94.98 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.316 -0.954 . . . . 0.0 108.802 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 19' ' ' SER . 64.7 m -54.53 -42.66 71.16 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.013 -1.054 . . . . 0.0 108.684 178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -61.69 -37.63 84.83 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.167 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.32 53.12 1.47 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.234 -0.916 . . . . 0.0 110.423 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.71 38.22 3.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.1 -1.0 . . . . 0.0 110.101 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.25 130.01 4.45 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 -59.29 -23.98 62.88 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.231 -1.158 . . . . 0.0 110.854 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -71.06 -27.48 63.67 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 120.819 -1.176 . . . . 0.0 111.45 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -49.55 -37.89 28.88 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.735 -1.228 . . . . 0.0 110.806 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -63.17 -54.2 41.38 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.087 -1.008 . . . . 0.0 109.112 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -60.46 -40.14 90.14 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.144 -0.972 . . . . 0.0 109.057 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -55.98 -37.22 68.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.223 -0.923 . . . . 0.0 110.046 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 73.8 t -55.92 -33.64 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.589 0 O-C-N 121.129 -0.982 . . . . 0.0 110.291 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 5.0 tttt -53.2 -41.94 65.79 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.825 -1.172 . . . . 0.0 109.994 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.56 -27.77 64.89 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.437 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.02 -52.26 13.3 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.877 -1.139 . . . . 0.0 110.499 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.01 31.63 2.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.004 -1.06 . . . . 0.0 111.656 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.59 -38.3 59.2 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.661 -1.274 . . . . 0.0 110.027 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.7 mttt -113.28 34.24 4.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.255 -0.903 . . . . 0.0 110.563 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -98.21 -47.12 5.58 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -148.14 -63.63 0.25 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.352 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -120.24 -177.29 3.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.305 -0.872 . . . . 0.0 110.251 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -97.72 -37.73 9.77 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.19 -0.943 . . . . 0.0 110.68 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -109.72 112.33 24.33 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.049 -1.032 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.423 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -148.74 76.74 1.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.217 -0.927 . . . . 0.0 110.242 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -106.48 35.71 2.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.063 -1.023 . . . . 0.0 110.462 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.9 -55.17 2.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.069 -1.019 . . . . 0.0 109.276 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.262 -0.899 . . . . 0.0 111.316 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.6 mm -70.37 -44.78 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.7 -1.25 . . . . 0.0 109.514 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -58.13 -40.8 82.2 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.189 -0.944 . . . . 0.0 110.029 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -61.19 -34.91 75.84 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.234 -0.916 . . . . 0.0 110.483 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m -87.59 -46.24 9.72 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.979 -1.076 . . . . 0.0 110.174 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.7 p -58.74 -37.63 76.62 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.072 -1.017 . . . . 0.0 110.251 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.86 -43.74 9.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.141 -0.974 . . . . 0.0 110.331 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -98.77 35.43 1.85 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.169 -0.957 . . . . 0.0 111.309 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -58.83 -57.59 12.34 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.973 -1.079 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -137.7 77.02 1.61 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.162 -0.961 . . . . 0.0 110.292 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -147.24 -59.18 0.27 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.38 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -119.77 -61.33 0.26 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.6 mttt . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.236 -1.156 . . . . 0.0 110.171 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.63 145.0 40.87 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.448 1.236 . . . . 0.0 110.477 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -148.21 140.97 24.62 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.148 -0.97 . . . . 0.0 110.352 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -111.86 162.66 15.05 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.269 -0.894 . . . . 0.0 110.01 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -137.75 137.1 37.94 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.033 -1.042 . . . . 0.0 110.853 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.2 t -114.23 100.74 8.58 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.177 -0.952 . . . . 0.0 109.91 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -58.09 -37.08 73.83 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.098 -1.002 . . . . 0.0 110.704 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CD1' HG12 ' A' ' 34' ' ' VAL . 25.0 m-85 -61.4 -34.96 76.23 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 120.996 -1.065 . . . . 0.0 110.046 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.6 m -90.03 -4.12 57.58 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.095 -1.003 . . . . 0.0 111.826 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.9 t70 53.74 39.4 30.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.393 -1.442 . . . . 0.0 110.473 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.18 171.89 13.44 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.279 -0.888 . . . . 0.0 109.995 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.4 120.81 37.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.243 -0.911 . . . . 0.0 110.086 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -74.7 166.91 22.81 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.13 -0.981 . . . . 0.0 109.559 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.9 t -101.12 -29.44 12.13 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.106 -0.996 . . . . 0.0 111.889 -179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -114.62 148.11 38.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.782 -1.199 . . . . 0.0 110.342 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -124.59 97.52 5.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.203 -0.936 . . . . 0.0 109.764 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.423 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.29 178.08 1.56 Allowed Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.226 -0.921 . . . . 0.0 110.263 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -70.56 -30.67 18.24 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 O-C-N 123.405 1.213 . . . . 0.0 110.93 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.404 ' O ' ' OG1' ' A' ' 23' ' ' THR . 27.7 m -90.32 -39.78 12.52 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.978 -1.076 . . . . 0.0 109.989 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.5 t -60.2 -52.34 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.034 -1.041 . . . . 0.0 109.509 179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -57.61 -49.39 76.56 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 121.13 -0.981 . . . . 0.0 109.583 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -41.4 99.09 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.728 178.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.404 ' OG1' ' O ' ' A' ' 19' ' ' SER . 78.8 m -54.59 -43.33 72.05 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.157 -0.964 . . . . 0.0 108.493 178.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.87 -37.16 85.76 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.648 -0.821 . . . . 0.0 109.062 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 50.32 1.04 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.206 -0.934 . . . . 0.0 110.331 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.22 38.11 3.32 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.057 -1.027 . . . . 0.0 110.382 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.34 126.41 2.39 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.836 -1.305 . . . . 0.0 109.836 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -53.75 -28.92 37.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.211 -1.17 . . . . 0.0 110.263 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -59.13 -32.74 70.12 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.05 -1.031 . . . . 0.0 110.605 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -49.54 -37.08 25.6 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.92 -1.112 . . . . 0.0 111.043 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -60.67 -53.62 55.27 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.071 -1.018 . . . . 0.0 109.157 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -39.03 85.52 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.181 -0.95 . . . . 0.0 109.03 178.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -56.03 -37.16 68.83 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.281 -0.887 . . . . 0.0 110.18 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CD1' ' A' ' 8' ' ' TYR . 96.3 t -58.83 -37.2 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.06 -1.025 . . . . 0.0 109.796 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 38' ' ' TYR . 9.0 tttp -54.76 -40.83 69.77 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.93 -1.106 . . . . 0.0 109.716 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.59 -32.4 70.35 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.95 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -65.51 -51.32 60.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.997 -1.064 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 45.8 p90 -99.87 34.21 2.35 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.06 -1.025 . . . . 0.0 111.323 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -39.21 15.87 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.813 -1.179 . . . . 0.0 109.733 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -114.27 34.55 4.63 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.237 -0.914 . . . . 0.0 110.358 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.459 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.6 t90 -88.5 -47.61 8.2 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.181 -0.949 . . . . 0.0 110.162 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.459 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -151.98 -64.18 0.17 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.182 -0.949 . . . . 0.0 110.639 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -129.24 -171.48 2.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.221 -0.924 . . . . 0.0 110.147 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -109.52 -179.74 3.91 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.22 -0.925 . . . . 0.0 110.14 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 53.27 74.56 0.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.121 -0.987 . . . . 0.0 110.687 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -135.23 73.5 1.48 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.271 -0.893 . . . . 0.0 110.166 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -112.18 35.19 3.86 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.203 -0.936 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.09 -54.21 2.56 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.054 -1.029 . . . . 0.0 109.325 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -21.24 63.1 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.268 -0.895 . . . . 0.0 111.334 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.455 HD11 HG22 ' A' ' 50' ' ' ILE . 48.1 mm -74.05 -43.31 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.646 -1.284 . . . . 0.0 109.536 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.43 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 20.0 m-20 -64.53 -39.97 94.76 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.234 -0.916 . . . . 0.0 109.978 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -63.58 -33.64 76.05 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.229 -0.92 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.4 m -90.03 -39.15 13.12 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.066 -1.021 . . . . 0.0 110.39 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.43 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 5.5 p -57.84 -38.73 76.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.025 -1.047 . . . . 0.0 110.258 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.89 -48.51 81.4 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.167 -0.958 . . . . 0.0 109.954 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.4 76.38 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.221 -0.924 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -51.64 -37.02 48.44 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -131.68 76.69 1.72 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.123 -0.986 . . . . 0.0 110.152 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -109.59 -53.05 2.71 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.204 -0.935 . . . . 0.0 110.303 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 142.21 109.46 0.74 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 109.741 -1.344 . . . . 0.0 109.741 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.727 0 O-C-N 121.255 -1.144 . . . . 0.0 110.234 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.11 125.5 9.84 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.424 1.223 . . . . 0.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.9 mttt 56.26 168.08 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.297 -0.877 . . . . 0.0 110.733 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -124.89 162.21 24.9 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.11 -0.994 . . . . 0.0 109.912 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -139.7 132.43 29.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.231 -0.918 . . . . 0.0 110.434 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 t -112.84 89.88 3.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.204 -0.935 . . . . 0.0 109.973 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -51.31 -35.77 39.41 Favored 'General case' 0 N--CA 1.515 2.82 0 O-C-N 121.05 -1.031 . . . . 0.0 110.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.431 ' CE2' HG12 ' A' ' 34' ' ' VAL . 88.0 m-85 -59.92 -31.0 69.42 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.117 -0.99 . . . . 0.0 110.063 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.3 m -99.41 -0.15 41.48 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.929 -1.107 . . . . 0.0 112.239 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 52.84 38.41 26.63 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.326 -1.484 . . . . 0.0 110.656 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -142.16 170.46 15.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.224 -0.923 . . . . 0.0 110.022 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -121.45 142.92 49.56 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.212 -0.93 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -102.73 156.58 17.54 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.251 -0.906 . . . . 0.0 109.406 179.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.3 t -98.86 -30.83 12.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.13 -0.981 . . . . 0.0 111.594 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -111.19 126.93 55.38 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.814 -1.179 . . . . 0.0 110.175 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -110.03 92.52 4.08 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.237 -0.915 . . . . 0.0 109.647 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.42 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -135.61 -179.72 1.15 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.43 -0.794 . . . . 0.0 109.765 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.72 -28.35 17.13 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.185 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -90.84 -43.55 9.97 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.881 -1.137 . . . . 0.0 110.07 179.606 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.5 t -59.14 -53.29 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.57 0 O-C-N 121.039 -1.038 . . . . 0.0 109.838 179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.95 -50.14 73.54 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.074 -1.016 . . . . 0.0 109.625 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -61.91 -40.8 96.7 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.133 -0.98 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 81.6 m -54.56 -43.43 72.03 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.075 -1.016 . . . . 0.0 108.496 178.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -63.35 -40.91 98.57 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -93.25 56.61 2.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.342 -0.849 . . . . 0.0 110.197 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -119.11 37.09 4.23 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.131 -0.981 . . . . 0.0 110.401 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.29 123.37 1.74 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -51.12 -30.39 16.18 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.204 -1.174 . . . . 0.0 110.672 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -57.66 -33.79 68.7 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.013 -1.054 . . . . 0.0 110.596 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -50.49 -42.43 54.68 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.92 -1.113 . . . . 0.0 110.728 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -62.97 -53.31 56.07 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.107 -0.996 . . . . 0.0 109.055 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.68 88.89 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.232 -0.918 . . . . 0.0 109.04 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -55.66 -38.61 69.82 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.215 -0.928 . . . . 0.0 110.024 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' CE2' ' A' ' 8' ' ' TYR . 75.4 t -61.62 -38.76 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 121.176 -0.952 . . . . 0.0 109.662 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 12.8 mtmt -58.45 -45.24 88.96 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.053 -1.029 . . . . 0.0 109.395 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.92 -25.66 63.66 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.274 -0.891 . . . . 0.0 110.362 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -72.9 -50.78 21.62 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.84 -1.162 . . . . 0.0 110.583 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 37.6 p90 -99.85 34.88 2.15 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.994 -1.067 . . . . 0.0 111.464 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -38.96 14.22 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.769 -1.207 . . . . 0.0 109.871 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.42 32.02 6.07 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.268 -0.895 . . . . 0.0 110.663 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.44 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 17.4 t90 -85.39 -37.93 19.29 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.126 -0.984 . . . . 0.0 110.315 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.44 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 1.9 mtm -142.48 -67.36 0.38 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.103 -0.998 . . . . 0.0 110.206 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -156.98 38.82 0.31 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.095 -1.003 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 52.05 38.33 23.74 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.087 -1.008 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.37 74.8 1.55 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.104 -0.997 . . . . 0.0 110.2 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -154.83 73.44 0.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.199 -0.938 . . . . 0.0 110.687 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.45 35.15 4.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.947 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.4 t -109.86 -54.74 2.53 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.154 -0.966 . . . . 0.0 109.369 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.12 -20.01 64.97 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.282 -0.886 . . . . 0.0 111.365 179.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.418 HG13 ' CE1' ' A' ' 38' ' ' TYR . 50.0 mm -74.64 -41.09 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.698 -1.251 . . . . 0.0 109.914 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.403 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 3.5 t70 -67.29 -39.62 86.02 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.909 . . . . 0.0 110.146 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -56.3 -37.09 69.42 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.095 -1.003 . . . . 0.0 110.47 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.0 m -92.1 -36.29 13.42 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.227 -0.921 . . . . 0.0 110.567 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.403 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 68.1 p -76.78 -42.72 39.68 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.55 94.41 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.215 -0.928 . . . . 0.0 110.0 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.93 30.21 3.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.115 -0.991 . . . . 0.0 111.595 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.92 -58.31 2.37 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.844 -1.16 . . . . 0.0 110.073 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -143.91 78.31 1.58 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.165 -0.96 . . . . 0.0 110.224 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -118.72 66.27 0.77 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.093 -1.004 . . . . 0.0 110.161 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.71 43.36 1.74 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.208 . . . . 0.0 110.171 -179.933 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.6 ttm . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.68 79.62 1.87 Allowed 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.411 1.216 . . . . 0.0 110.481 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 41.6 mttt -122.44 146.54 47.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.147 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CE1' ' HD3' ' A' ' 21' ' ' ARG . 84.8 t80 -111.6 161.85 15.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.176 -0.953 . . . . 0.0 110.328 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -129.04 139.28 52.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.268 -0.895 . . . . 0.0 110.146 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -118.21 98.35 6.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.131 -0.981 . . . . 0.0 109.912 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.98 -36.05 48.47 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 121.033 -1.042 . . . . 0.0 110.75 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.419 ' CE2' HG12 ' A' ' 34' ' ' VAL . 82.2 m-85 -63.48 -30.92 71.96 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.036 -1.04 . . . . 0.0 110.254 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.0 m -99.46 -11.11 21.39 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.981 -1.075 . . . . 0.0 112.03 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t0 56.72 40.89 28.93 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.409 -1.432 . . . . 0.0 110.076 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -141.56 172.95 11.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.248 -0.907 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.415 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.5 t80 -119.92 128.41 53.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.304 -0.873 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.27 169.75 16.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.2 -0.937 . . . . 0.0 109.732 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.417 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -97.43 -31.99 12.08 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.169 -0.957 . . . . 0.0 111.346 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.417 ' CD2' HG21 ' A' ' 14' ' ' THR . 39.1 m-70 -116.04 137.6 51.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.91 -1.118 . . . . 0.0 110.126 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -114.19 96.44 5.8 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.209 -0.932 . . . . 0.0 109.838 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.36 177.96 1.61 Allowed Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.256 -0.902 . . . . 0.0 110.172 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -71.02 -31.21 15.34 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.372 1.196 . . . . 0.0 111.082 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.411 ' O ' ' OG1' ' A' ' 23' ' ' THR . 36.6 m -87.2 -39.76 15.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.912 -1.117 . . . . 0.0 110.084 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.2 t -61.02 -47.81 91.9 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.226 -0.921 . . . . 0.0 109.716 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 20.5 mtt180 -57.53 -53.73 54.81 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.146 -0.972 . . . . 0.0 109.725 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -60.61 -40.08 90.54 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.191 -0.943 . . . . 0.0 109.009 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 19' ' ' SER . 95.1 m -56.22 -43.44 78.56 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.083 -1.011 . . . . 0.0 108.421 178.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.32 -36.87 81.34 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.028 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -97.48 49.38 1.04 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.146 -0.971 . . . . 0.0 110.389 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.82 37.76 3.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.12 -0.988 . . . . 0.0 110.284 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.61 129.51 4.02 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -54.42 -28.57 44.85 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.152 -1.205 . . . . 0.0 110.481 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -61.2 -35.16 76.43 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.996 -1.065 . . . . 0.0 110.503 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -51.68 -38.45 55.07 Favored 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.908 -1.12 . . . . 0.0 110.599 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -61.6 -55.74 27.41 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.114 -0.991 . . . . 0.0 109.245 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -58.97 -38.51 79.27 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.206 -0.934 . . . . 0.0 109.173 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.18 -38.33 70.79 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.163 -0.961 . . . . 0.0 110.128 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG12 ' CE2' ' A' ' 8' ' ' TYR . 98.2 t -63.52 -36.85 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.099 -1.001 . . . . 0.0 109.847 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -52.53 -40.58 62.62 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.007 -1.058 . . . . 0.0 109.821 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.71 -30.14 65.28 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.314 -0.866 . . . . 0.0 110.316 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.46 -53.48 19.03 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.885 -1.134 . . . . 0.0 109.946 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -100.11 34.39 2.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 111.198 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.77 -36.96 56.68 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 120.781 -1.199 . . . . 0.0 110.341 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.21 22.99 13.1 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.101 -0.999 . . . . 0.0 111.294 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.8 t90 -104.89 -49.46 3.49 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.865 -1.147 . . . . 0.0 110.238 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.469 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -103.54 -46.7 4.48 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.127 -0.983 . . . . 0.0 110.299 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 53.7 38.5 28.55 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.984 -1.073 . . . . 0.0 110.775 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -156.93 -65.82 0.1 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.634 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -164.69 77.68 0.33 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.18 -0.95 . . . . 0.0 110.788 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.84 73.7 1.16 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.166 -0.959 . . . . 0.0 110.431 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.1 35.9 4.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.284 -0.885 . . . . 0.0 110.388 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.0 m -111.21 -52.9 2.75 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.106 -0.996 . . . . 0.0 109.798 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.2 -21.3 61.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.134 -0.979 . . . . 0.0 111.551 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.403 ' O ' ' OG1' ' A' ' 54' ' ' THR . 47.4 mm -70.75 -38.61 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 120.719 -1.238 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -86.62 -39.97 15.6 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.106 -0.996 . . . . 0.0 110.065 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -64.27 -31.79 73.13 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.222 -0.924 . . . . 0.0 110.652 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.3 m -87.38 -44.94 10.99 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.964 -1.085 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 16.9 p -56.04 -35.68 67.15 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 121.093 -1.004 . . . . 0.0 110.688 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.64 -39.75 15.79 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.062 -1.024 . . . . 0.0 109.919 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.99 85.36 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.111 -0.993 . . . . 0.0 110.162 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.67 -38.47 55.09 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.964 -1.085 . . . . 0.0 110.607 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -107.37 -50.98 2.98 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.147 -0.971 . . . . 0.0 110.391 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -113.2 66.4 0.65 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 110.259 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.02 -74.79 0.68 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tttt . . . . . 0 N--CA 1.495 1.777 0 O-C-N 121.254 -1.145 . . . . 0.0 110.211 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.55 142.51 36.55 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.382 1.201 . . . . 0.0 110.433 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.2 mttp 55.79 170.46 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.213 -0.929 . . . . 0.0 110.636 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -126.38 162.36 25.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.103 -0.998 . . . . 0.0 110.093 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -141.25 132.01 25.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -0.956 . . . . 0.0 110.393 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.4 t -110.63 88.87 2.88 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.203 -0.935 . . . . 0.0 109.553 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -50.96 -36.48 39.15 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.153 -0.967 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.441 ' CD2' ' CG1' ' A' ' 34' ' ' VAL . 26.6 m-85 -61.79 -30.55 70.89 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.041 -1.037 . . . . 0.0 110.127 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.0 m -98.15 -0.88 43.46 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.997 -1.064 . . . . 0.0 111.997 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 53.01 38.27 26.82 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.423 -1.423 . . . . 0.0 110.791 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.9 t -139.59 168.05 20.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.155 -0.966 . . . . 0.0 109.872 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -120.91 143.77 48.78 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.155 -0.966 . . . . 0.0 110.637 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.25 140.23 39.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -102.33 -21.03 14.38 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.074 -1.016 . . . . 0.0 112.441 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 40.0 m-70 -103.58 67.49 0.9 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.636 -1.29 . . . . 0.0 110.02 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.44 101.7 0.11 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.24 -0.912 . . . . 0.0 110.038 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.72 178.18 1.57 Allowed Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.026 -1.046 . . . . 0.0 110.251 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.88 -30.17 17.46 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.403 1.212 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.423 ' O ' ' OG1' ' A' ' 23' ' ' THR . 40.3 m -90.26 -40.77 11.96 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.888 -1.133 . . . . 0.0 109.961 179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.1 t -59.6 -56.16 19.06 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.626 0 O-C-N 121.053 -1.029 . . . . 0.0 109.75 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.7 mtp85 -55.27 -50.28 69.92 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.072 -1.017 . . . . 0.0 109.899 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -62.34 -40.64 97.04 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.285 -0.966 . . . . 0.0 108.802 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 19' ' ' SER . 52.9 m -55.5 -43.08 75.32 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.097 -1.002 . . . . 0.0 108.368 178.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -64.73 -37.79 88.78 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.6 -0.84 . . . . 0.0 108.953 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -97.63 57.0 1.33 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.171 -0.956 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.13 37.73 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.129 -0.982 . . . . 0.0 110.443 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.13 122.69 1.25 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.84 -29.61 28.88 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.091 -1.241 . . . . 0.0 110.134 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -56.78 -31.99 65.21 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 33.9 t-80 -47.34 -38.64 13.29 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.132 -0.98 . . . . 0.0 111.306 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -55.06 26.74 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.006 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -59.49 -39.1 82.68 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.183 -0.948 . . . . 0.0 109.092 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -54.64 -36.38 64.47 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.194 -0.941 . . . . 0.0 110.261 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.441 ' CG1' ' CD2' ' A' ' 8' ' ' TYR . 89.1 t -55.34 -37.81 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.733 0 O-C-N 121.056 -1.027 . . . . 0.0 110.093 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 7.1 tttp -54.26 -39.67 67.07 Favored 'General case' 0 N--CA 1.514 2.737 0 O-C-N 121.073 -1.017 . . . . 0.0 109.894 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -59.8 -32.26 70.47 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.036 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 33.5 t80 -64.87 -52.17 58.06 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.954 -1.091 . . . . 0.0 110.169 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 49.3 p90 -100.38 34.69 2.31 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.097 -1.002 . . . . 0.0 111.15 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.6 14.56 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.736 -1.228 . . . . 0.0 109.788 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.36 34.47 4.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.247 -0.908 . . . . 0.0 110.415 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.436 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.7 t90 -93.5 -38.82 11.21 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.153 -0.967 . . . . 0.0 110.273 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.436 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.3 ttm -145.87 -62.19 0.33 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.177 -0.952 . . . . 0.0 110.392 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -143.35 -164.46 1.87 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.182 -0.949 . . . . 0.0 110.05 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.29 39.26 2.34 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.111 -0.993 . . . . 0.0 110.201 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -150.41 75.1 1.21 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.418 ' HB1' ' CD1' ' A' ' 38' ' ' TYR . . . -139.47 72.1 1.39 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.214 -0.928 . . . . 0.0 110.181 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.06 35.92 4.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.343 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -110.28 -54.94 2.52 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.147 -0.97 . . . . 0.0 109.309 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -21.06 64.12 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.204 -0.935 . . . . 0.0 111.208 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.425 HG13 ' CE2' ' A' ' 38' ' ' TYR . 48.3 mm -74.36 -54.59 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.653 -1.28 . . . . 0.0 109.517 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.422 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 5.3 t0 -55.56 -39.67 70.94 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.14 -0.975 . . . . 0.0 110.3 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.7 tttt -59.74 -37.15 78.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.128 -0.983 . . . . 0.0 110.304 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 m -90.85 -40.52 11.71 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.064 -1.022 . . . . 0.0 110.076 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.422 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 66.8 p -68.27 -35.84 78.5 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.207 -0.933 . . . . 0.0 110.198 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.79 -41.62 11.13 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.038 -1.038 . . . . 0.0 110.024 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -98.5 31.75 2.75 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.171 -0.956 . . . . 0.0 111.428 179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.28 -58.35 8.65 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.961 -1.087 . . . . 0.0 109.863 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 52.25 39.07 26.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.096 -1.003 . . . . 0.0 110.954 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.27 39.3 26.85 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.001 -1.062 . . . . 0.0 110.782 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.28 -76.17 1.07 Allowed Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt . . . . . 0 N--CA 1.494 1.763 0 O-C-N 121.202 -1.175 . . . . 0.0 110.2 -179.977 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.4 ttm . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.91 110.45 3.04 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.29 1.153 . . . . 0.0 110.3 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 5.7 mttt -129.19 150.97 50.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.195 -0.94 . . . . 0.0 110.097 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CE2' ' CD ' ' A' ' 21' ' ' ARG . 57.9 t80 -110.72 161.49 15.71 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.128 -0.983 . . . . 0.0 110.491 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 34.7 t80 -135.58 134.58 39.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.225 -0.922 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 39.3 t -114.27 96.67 5.91 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.125 -0.984 . . . . 0.0 110.1 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -53.52 -36.2 61.5 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.075 -1.016 . . . . 0.0 110.468 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.426 ' CE2' HG12 ' A' ' 34' ' ' VAL . 90.9 m-85 -61.45 -32.76 72.75 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.138 -0.976 . . . . 0.0 110.074 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.9 m -96.51 -5.33 39.68 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.996 -1.065 . . . . 0.0 112.187 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 53.44 39.86 30.53 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.441 -1.412 . . . . 0.0 110.388 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -141.62 172.09 13.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.332 -0.855 . . . . 0.0 109.956 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.408 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 13.0 t80 -119.41 137.89 53.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.315 -0.866 . . . . 0.0 110.479 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 mp -96.59 168.29 10.62 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.237 -0.915 . . . . 0.0 109.587 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.406 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.2 t -98.88 -30.13 12.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.166 -0.958 . . . . 0.0 111.777 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 14' ' ' THR . 49.5 m-70 -113.06 148.73 34.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.909 -1.119 . . . . 0.0 110.413 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -126.56 96.88 4.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.338 -0.851 . . . . 0.0 109.678 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -150.46 178.5 1.49 Allowed Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.258 -0.901 . . . . 0.0 110.283 -179.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -70.43 -32.01 16.55 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.37 1.195 . . . . 0.0 110.897 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.41 ' O ' ' OG1' ' A' ' 23' ' ' THR . 50.2 m -86.07 -40.34 15.83 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 120.929 -1.107 . . . . 0.0 109.878 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.8 t -61.94 -50.2 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.194 -0.941 . . . . 0.0 109.496 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' CD ' ' CE2' ' A' ' 4' ' ' PHE . 36.2 mtm-85 -57.45 -50.24 73.67 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.49 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.49 -40.91 96.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.139 -0.976 . . . . 0.0 108.674 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.1 m -54.57 -43.69 72.29 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.122 -0.987 . . . . 0.0 108.463 178.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -62.77 -39.99 95.89 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -93.07 55.75 2.4 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.267 -0.896 . . . . 0.0 110.35 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.89 37.29 4.25 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.063 -1.023 . . . . 0.0 110.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.87 126.95 2.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -28.3 42.98 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.126 -1.22 . . . . 0.0 110.462 179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -60.94 -32.4 71.92 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.972 -1.08 . . . . 0.0 110.708 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -50.22 -39.95 45.98 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.946 -1.096 . . . . 0.0 110.75 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 -52.81 60.1 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.071 -1.018 . . . . 0.0 108.89 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -61.26 -39.73 91.45 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.481 -0.888 . . . . 0.0 108.918 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -56.29 -38.56 71.39 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.237 -0.915 . . . . 0.0 109.981 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' CE2' ' A' ' 8' ' ' TYR . 73.5 t -56.84 -35.47 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.646 0 O-C-N 121.091 -1.005 . . . . 0.0 110.027 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.0 tttt -53.07 -42.82 66.22 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.999 -1.063 . . . . 0.0 109.935 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -57.51 -31.35 65.94 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.196 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -64.31 -51.3 64.13 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.991 -1.068 . . . . 0.0 110.148 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.2 p90 -100.37 33.62 2.63 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.152 -0.967 . . . . 0.0 111.352 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -91.16 -38.52 12.68 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.801 -1.187 . . . . 0.0 110.054 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -111.28 29.11 8.1 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.221 -0.924 . . . . 0.0 110.894 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.438 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 25.9 t90 -92.56 -40.07 11.0 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.002 -1.061 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.438 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.0 tpp -145.8 -60.4 0.33 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.073 -1.017 . . . . 0.0 110.286 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.32 -164.63 2.02 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.199 -0.938 . . . . 0.0 110.242 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -109.89 39.39 2.14 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.198 -0.939 . . . . 0.0 110.134 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -152.0 75.89 1.16 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.158 -0.964 . . . . 0.0 110.36 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.401 ' HB1' ' CD2' ' A' ' 38' ' ' TYR . . . -138.94 74.29 1.47 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.237 -0.914 . . . . 0.0 110.272 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -111.89 35.86 3.54 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.191 -0.943 . . . . 0.0 110.341 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.4 p -110.48 -53.78 2.65 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.172 -0.955 . . . . 0.0 109.547 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.31 63.3 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.252 -0.905 . . . . 0.0 111.322 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 48.1 mm -73.27 -54.5 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 120.61 -1.306 . . . . 0.0 109.552 179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -57.29 -39.49 75.83 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.185 -0.947 . . . . 0.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -63.85 -35.08 79.46 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.218 -0.926 . . . . 0.0 110.458 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.402 HG23 ' CD1' ' A' ' 57' ' ' PHE . 42.5 m -90.4 -46.93 8.05 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.028 -1.045 . . . . 0.0 110.235 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.5 p -55.45 -34.43 64.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.069 -1.019 . . . . 0.0 110.698 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -87.93 -36.99 16.8 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.046 -1.034 . . . . 0.0 110.33 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -98.12 37.18 1.46 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.001 -1.062 . . . . 0.0 111.131 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.402 ' CD1' HG23 ' A' ' 53' ' ' THR . 1.1 t80 -91.55 -39.17 12.06 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.95 -1.094 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -113.74 65.83 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.156 -0.965 . . . . 0.0 110.243 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -120.32 40.36 3.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.107 -0.995 . . . . 0.0 110.171 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -101.32 59.99 0.61 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.8 pttp . . . . . 0 N--CA 1.496 1.837 0 O-C-N 121.239 -1.154 . . . . 0.0 110.283 179.997 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.62 148.04 46.66 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.374 1.197 . . . . 0.0 110.529 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -143.92 158.95 43.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.402 ' O ' ' CD1' ' A' ' 12' ' ' TYR . 62.6 t80 -115.08 154.68 28.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.192 -0.943 . . . . 0.0 109.868 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 11' ' ' THR . 66.2 t80 -130.93 141.03 50.25 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.007 -1.058 . . . . 0.0 110.563 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.2 t -119.15 92.61 3.84 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.289 -0.882 . . . . 0.0 109.793 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -53.09 -36.48 60.75 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.093 -1.005 . . . . 0.0 111.064 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CD1' HG12 ' A' ' 34' ' ' VAL . 25.0 m-85 -62.15 -32.58 73.2 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 120.997 -1.064 . . . . 0.0 109.957 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 45.9 m -94.73 -1.33 53.2 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.989 -1.069 . . . . 0.0 111.934 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.88 38.27 28.34 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.304 -1.498 . . . . 0.0 110.439 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.406 ' O ' ' CD1' ' A' ' 5' ' ' TYR . 8.3 t -143.38 171.53 14.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.164 -0.96 . . . . 0.0 110.011 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.7 OUTLIER -129.86 131.26 46.04 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 109.954 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -87.99 161.67 17.27 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.117 -0.989 . . . . 0.0 110.145 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -97.22 -29.98 13.26 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.998 -1.064 . . . . 0.0 111.6 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.9 m-70 -106.88 130.77 54.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.903 -1.123 . . . . 0.0 109.974 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -114.18 76.89 1.01 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.165 -0.959 . . . . 0.0 110.002 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -119.87 -179.11 0.65 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.278 -0.889 . . . . 0.0 109.934 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.83 -26.56 15.6 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.292 1.154 . . . . 0.0 111.507 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.41 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.1 t -92.06 -42.71 9.81 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.752 -1.218 . . . . 0.0 110.196 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 81.4 t -57.82 -53.12 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.018 . . . . 0.0 109.932 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 mtp180 -55.98 -51.12 68.84 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.023 -1.048 . . . . 0.0 109.809 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -61.98 -40.8 96.85 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.143 -0.973 . . . . 0.0 108.728 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.5 m -54.64 -43.03 71.96 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.215 -0.928 . . . . 0.0 108.504 178.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -62.88 -37.8 88.34 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 119.627 -0.829 . . . . 0.0 108.979 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -97.26 51.39 1.1 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.224 -0.922 . . . . 0.0 110.2 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.32 37.99 3.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.355 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.4 127.76 2.84 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.52 -28.33 44.57 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.205 -1.173 . . . . 0.0 110.496 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -61.12 -33.15 72.92 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.88 -1.138 . . . . 0.0 110.669 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -50.33 -41.34 51.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.933 -1.105 . . . . 0.0 110.87 -179.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -61.79 -56.08 23.27 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.236 179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -59.0 -38.02 78.23 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.159 -0.963 . . . . 0.0 109.157 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -56.35 -39.35 72.73 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.113 -0.992 . . . . 0.0 110.041 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG12 ' CD1' ' A' ' 8' ' ' TYR . 84.2 t -62.86 -39.28 84.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 109.544 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -59.59 -42.45 92.6 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.058 -1.026 . . . . 0.0 109.215 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.42 -31.48 69.31 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.062 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -69.85 -51.73 30.97 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.922 -1.111 . . . . 0.0 110.249 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 42.3 p90 -99.88 33.89 2.44 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.073 -1.017 . . . . 0.0 111.34 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -39.73 17.46 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.78 -1.2 . . . . 0.0 109.874 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -90.34 -29.65 17.94 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.25 -0.906 . . . . 0.0 110.372 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.436 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 8.1 t90 -46.6 -33.89 4.53 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.086 -1.009 . . . . 0.0 111.788 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.436 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 1.5 mtt -151.77 -55.22 0.14 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.992 -1.068 . . . . 0.0 111.198 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 59.26 40.08 21.82 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.902 -1.124 . . . . 0.0 110.027 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -147.41 85.91 1.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.224 -0.922 . . . . 0.0 110.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 53.55 74.22 0.33 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.001 -1.062 . . . . 0.0 110.635 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -143.4 69.45 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.21 -0.931 . . . . 0.0 110.207 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -129.95 32.75 4.5 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 0.0 110.634 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.6 m -102.89 -48.21 4.14 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.055 -1.028 . . . . 0.0 109.605 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -21.64 61.84 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.184 -0.948 . . . . 0.0 111.42 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.428 HG13 ' CZ ' ' A' ' 38' ' ' TYR . 50.5 mm -83.47 -40.84 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.368 0 O-C-N 120.601 -1.312 . . . . 0.0 109.938 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.42 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -58.72 -40.35 83.47 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.168 -0.958 . . . . 0.0 110.09 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.31 -35.51 67.62 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.581 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.1 m -90.83 -35.93 14.51 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.047 -1.033 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.42 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 73.0 p -77.04 -40.27 46.99 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.986 -1.071 . . . . 0.0 110.04 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.01 89.59 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.177 -0.952 . . . . 0.0 109.955 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.59 -34.4 58.26 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.071 -1.018 . . . . 0.0 110.874 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -89.05 -35.93 16.07 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.993 -1.067 . . . . 0.0 110.42 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -76.23 -39.79 53.66 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.981 -1.074 . . . . 0.0 110.02 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -117.54 62.12 0.75 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.123 -0.986 . . . . 0.0 110.21 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.24 -109.01 3.35 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.3 ttpt . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.245 -1.15 . . . . 0.0 110.208 -179.996 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.85 77.61 2.27 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.493 1.26 . . . . 0.0 110.39 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -142.15 130.37 22.18 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.194 -0.941 . . . . 0.0 109.883 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.408 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 47.8 t80 -111.1 157.08 20.42 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.131 -0.981 . . . . 0.0 110.144 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -129.72 137.88 50.82 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.201 -0.937 . . . . 0.0 110.31 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.9 t -115.59 96.36 5.59 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.206 -0.934 . . . . 0.0 110.223 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -54.02 -36.35 62.9 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.057 -1.027 . . . . 0.0 110.341 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.419 ' CD2' HG12 ' A' ' 34' ' ' VAL . 82.7 m-85 -60.26 -33.97 73.07 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.071 -1.018 . . . . 0.0 110.039 179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.0 m -94.73 0.88 55.36 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.118 -0.989 . . . . 0.0 112.036 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.49 37.56 19.76 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.468 -1.395 . . . . 0.0 110.797 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -146.26 171.26 15.22 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.24 -0.913 . . . . 0.0 110.173 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.17 124.55 47.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.043 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.41 167.15 21.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.228 -0.92 . . . . 0.0 109.668 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.0 t -101.12 -28.46 12.68 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.139 -0.976 . . . . 0.0 111.951 -179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -111.22 144.67 40.0 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.726 -1.234 . . . . 0.0 110.167 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -123.09 92.58 3.73 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 109.887 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -141.82 178.26 1.59 Allowed Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.243 -0.911 . . . . 0.0 110.047 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.43 -30.81 14.8 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.465 1.245 . . . . 0.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.422 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.3 t -89.96 -40.5 12.32 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.947 -1.096 . . . . 0.0 109.991 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.3 t -58.96 -53.17 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.125 -0.985 . . . . 0.0 109.787 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.408 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 32.9 mtm180 -56.81 -51.57 68.46 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.075 -1.016 . . . . 0.0 109.735 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -61.82 -40.17 94.34 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.286 -0.966 . . . . 0.0 108.968 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 19' ' ' SER . 73.6 m -55.4 -42.61 74.29 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.053 -1.029 . . . . 0.0 108.482 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.93 -36.35 83.14 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.348 -0.845 . . . . 0.0 109.172 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.69 46.37 0.97 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.172 -0.955 . . . . 0.0 110.448 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.58 38.51 3.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.108 -0.995 . . . . 0.0 110.199 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.34 126.49 2.6 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -28.27 45.41 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.185 -1.186 . . . . 0.0 110.287 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -58.35 -33.95 70.11 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.894 -1.128 . . . . 0.0 110.479 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -50.45 -37.65 39.41 Favored 'General case' 0 N--CA 1.516 2.834 0 O-C-N 120.963 -1.086 . . . . 0.0 110.733 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -55.56 28.58 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.027 -1.046 . . . . 0.0 109.126 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.19 -39.25 82.01 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.238 -0.914 . . . . 0.0 109.179 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.53 -37.43 70.45 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.218 -0.926 . . . . 0.0 110.072 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG12 ' CD2' ' A' ' 8' ' ' TYR . 87.2 t -57.9 -37.67 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.023 -1.048 . . . . 0.0 109.944 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 21.0 tttp -54.32 -40.43 67.95 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.947 -1.095 . . . . 0.0 109.669 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -58.37 -28.97 65.63 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.24 -0.913 . . . . 0.0 110.276 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -70.93 -54.32 11.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.882 -1.136 . . . . 0.0 109.996 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.6 p90 -99.01 27.77 4.82 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.159 -0.963 . . . . 0.0 111.536 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -62.92 -36.8 84.57 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.699 -1.251 . . . . 0.0 110.381 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -109.29 28.51 8.44 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.192 -0.942 . . . . 0.0 111.019 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.442 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 18.6 t90 -103.42 -49.77 3.62 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.089 -1.007 . . . . 0.0 110.041 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.442 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 1.3 ttm -148.94 -57.51 0.21 Allowed 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.203 -0.935 . . . . 0.0 110.413 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 55.03 -165.51 0.11 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.924 -1.11 . . . . 0.0 110.388 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 53.41 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.036 -1.04 . . . . 0.0 110.371 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 55.49 69.92 0.69 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.979 -1.076 . . . . 0.0 110.338 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.82 69.05 1.07 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.239 -0.913 . . . . 0.0 110.375 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -131.6 33.0 4.07 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.285 -0.884 . . . . 0.0 110.71 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.8 p -103.76 -49.9 3.54 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.097 -1.002 . . . . 0.0 109.389 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.15 -21.11 63.46 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.24 -0.912 . . . . 0.0 111.319 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 50.5 mm -82.8 -40.15 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 120.723 -1.236 . . . . 0.0 109.951 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.427 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 26.7 t0 -76.58 -40.7 48.8 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -57.07 -33.33 67.16 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.076 -1.015 . . . . 0.0 110.652 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 78.0 m -90.49 -43.04 10.5 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.968 -1.082 . . . . 0.0 110.34 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.427 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.1 p -60.96 -40.23 92.57 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.084 -1.01 . . . . 0.0 110.004 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.25 92.49 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.209 -0.932 . . . . 0.0 109.976 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -51.75 -32.13 29.52 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.143 -0.973 . . . . 0.0 111.233 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -89.47 -35.08 16.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.989 -1.069 . . . . 0.0 110.705 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -100.87 -61.6 1.35 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.041 -1.037 . . . . 0.0 110.166 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 52.65 41.26 31.28 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.097 -1.002 . . . . 0.0 110.778 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 139.26 -60.33 0.58 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.115 -1.227 . . . . 0.0 110.13 179.986 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpp? . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.04 108.68 2.65 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 O-C-N 123.392 1.206 . . . . 0.0 110.624 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -139.29 150.05 44.97 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.265 -0.897 . . . . 0.0 110.124 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.426 ' CD1' ' HG2' ' A' ' 21' ' ' ARG . 89.6 t80 -107.08 161.54 14.66 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.225 -0.922 . . . . 0.0 109.992 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -137.76 137.36 38.19 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.114 -0.991 . . . . 0.0 110.222 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 t -120.71 92.84 3.86 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.258 -0.901 . . . . 0.0 110.043 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -52.7 -36.16 56.85 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.041 -1.037 . . . . 0.0 110.424 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.429 ' CE1' HG12 ' A' ' 34' ' ' VAL . 90.6 m-85 -60.13 -33.81 72.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.087 -1.008 . . . . 0.0 110.01 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.8 m -94.21 -2.54 52.34 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.101 -0.999 . . . . 0.0 112.129 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.57 40.45 31.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.38 -1.45 . . . . 0.0 110.554 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.8 t -145.93 169.95 17.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.246 -0.909 . . . . 0.0 110.328 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -120.86 140.58 51.58 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.166 -0.959 . . . . 0.0 110.688 -179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.2 mp -97.04 164.42 12.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 t -101.48 -21.83 14.68 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.127 -0.983 . . . . 0.0 112.319 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -121.83 137.33 54.82 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.596 -1.315 . . . . 0.0 110.198 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -116.09 88.28 2.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.184 -0.947 . . . . 0.0 109.845 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.414 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -132.5 178.54 1.71 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.265 -0.897 . . . . 0.0 109.898 -179.617 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -70.88 -28.27 20.09 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.39 1.205 . . . . 0.0 111.285 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 23' ' ' THR . 17.5 m -91.99 -43.17 9.59 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.891 -1.131 . . . . 0.0 110.125 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.8 t -58.58 -53.34 48.19 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.091 -1.006 . . . . 0.0 109.905 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.426 ' HG2' ' CD1' ' A' ' 4' ' ' PHE . 34.8 mtp180 -56.98 -50.0 74.01 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.034 -1.041 . . . . 0.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -40.53 96.62 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.122 -0.986 . . . . 0.0 108.692 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 19' ' ' SER . 87.7 m -54.0 -43.02 69.68 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.136 -0.977 . . . . 0.0 108.429 178.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.3 -38.65 91.98 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 119.565 -0.854 . . . . 0.0 108.822 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -98.57 47.36 0.99 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.206 -0.934 . . . . 0.0 110.466 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -115.37 40.13 2.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.14 -0.975 . . . . 0.0 109.887 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.68 147.86 19.43 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -76.88 -10.42 59.36 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.258 -1.142 . . . . 0.0 111.22 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -88.36 -26.09 22.39 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.652 -1.28 . . . . 0.0 111.079 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 19.2 t-80 -49.21 -40.16 32.5 Favored 'General case' 0 N--CA 1.518 2.949 0 O-C-N 120.814 -1.179 . . . . 0.0 110.903 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -62.72 -55.62 25.03 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.104 -0.998 . . . . 0.0 109.101 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.86 -38.65 82.73 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.208 -0.932 . . . . 0.0 109.124 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -56.62 -37.28 70.5 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.14 -0.975 . . . . 0.0 110.094 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.429 HG12 ' CE1' ' A' ' 8' ' ' TYR . 47.9 t -55.97 -36.52 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.029 -1.044 . . . . 0.0 109.993 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.4 ttpm? -55.38 -41.1 72.18 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 120.899 -1.125 . . . . 0.0 109.751 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -58.51 -26.05 63.06 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.308 -0.87 . . . . 0.0 110.552 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -73.64 -52.41 13.46 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.819 -1.176 . . . . 0.0 110.438 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.9 p90 -99.08 30.79 3.27 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.036 -1.04 . . . . 0.0 111.517 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -73.98 -41.45 61.9 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.668 -1.27 . . . . 0.0 109.692 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.09 22.85 11.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.314 -0.866 . . . . 0.0 111.117 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 24.9 t90 -56.41 -48.84 76.11 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.806 -1.184 . . . . 0.0 110.276 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.435 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -139.58 34.74 2.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.933 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 50.19 37.58 15.09 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.926 -1.109 . . . . 0.0 111.02 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -143.65 -172.84 3.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 110.279 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -109.12 114.25 27.81 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -113.92 76.59 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.286 -0.884 . . . . 0.0 110.216 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -108.85 36.37 2.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.168 -0.958 . . . . 0.0 110.371 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.29 -56.08 2.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.204 -0.935 . . . . 0.0 109.424 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.89 64.42 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.196 -0.94 . . . . 0.0 111.254 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.418 HG13 ' CE2' ' A' ' 38' ' ' TYR . 46.6 mm -69.35 -41.35 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.629 -1.294 . . . . 0.0 109.509 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.08 -39.05 56.21 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.281 -0.887 . . . . 0.0 110.007 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -34.54 72.22 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.158 -0.964 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.5 m -80.75 -40.01 25.93 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.024 -1.048 . . . . 0.0 110.223 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 19.6 p -62.83 -37.99 88.98 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.058 -1.026 . . . . 0.0 110.11 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.08 -43.76 9.21 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.119 -0.988 . . . . 0.0 110.183 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -93.9 57.54 2.47 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.139 -0.975 . . . . 0.0 110.186 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -92.5 -38.7 11.8 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.291 -0.881 . . . . 0.0 110.211 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -129.29 41.95 3.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.18 -0.95 . . . . 0.0 110.248 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.45 39.94 1.57 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.198 -0.939 . . . . 0.0 110.187 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -141.41 -98.42 0.33 Allowed Glycine 0 N--CA 1.494 2.552 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.0 mttt . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.197 -1.178 . . . . 0.0 110.217 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 tpt . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.53 154.72 55.25 Favored 'Trans proline' 0 C--N 1.318 -1.029 0 O-C-N 123.254 1.134 . . . . 0.0 110.453 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt 57.98 160.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.378 -0.826 . . . . 0.0 110.813 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -116.72 162.16 18.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.993 -1.067 . . . . 0.0 110.353 -179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -135.9 133.84 38.11 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -113.52 95.53 5.4 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.143 -0.973 . . . . 0.0 110.275 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -52.87 -35.94 58.42 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.065 -1.022 . . . . 0.0 110.34 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.436 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.2 m-85 -60.74 -31.99 71.29 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.136 -0.977 . . . . 0.0 110.11 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.9 m -98.59 -4.96 32.88 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.005 -1.059 . . . . 0.0 112.255 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 t0 54.14 39.59 30.85 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.46 -1.4 . . . . 0.0 110.337 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -142.16 172.96 11.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.195 -0.941 . . . . 0.0 110.032 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -120.03 135.44 54.93 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.262 -0.898 . . . . 0.0 110.594 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -95.43 165.38 12.39 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.166 -0.959 . . . . 0.0 109.442 179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.2 t -99.48 -22.16 15.62 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.063 -1.023 . . . . 0.0 112.031 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -117.17 145.95 43.51 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.721 -1.237 . . . . 0.0 110.282 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -127.81 92.85 3.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 109.569 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.426 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.81 178.93 1.28 Allowed Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.325 -0.86 . . . . 0.0 110.116 -179.529 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.426 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -70.53 -26.71 23.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.377 1.198 . . . . 0.0 111.108 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 23' ' ' THR . 4.1 m -92.66 -41.73 10.02 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.81 -1.181 . . . . 0.0 109.929 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 67.5 t -60.97 -52.49 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.128 -0.983 . . . . 0.0 109.602 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 -56.4 -50.37 71.82 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.053 -1.029 . . . . 0.0 109.558 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.25 -41.28 98.3 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.359 -0.936 . . . . 0.0 108.573 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 19' ' ' SER . 57.9 m -54.25 -43.68 71.12 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.081 -1.012 . . . . 0.0 108.445 178.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -62.22 -38.68 90.11 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.407 -0.808 . . . . 0.0 108.832 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -95.84 51.89 1.29 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.155 -0.966 . . . . 0.0 110.336 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.35 37.72 4.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.098 -1.001 . . . . 0.0 110.257 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.79 128.38 3.44 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 ttt-85 -53.83 -28.83 37.98 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.523 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -59.84 -36.35 76.67 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.925 -1.109 . . . . 0.0 110.349 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -52.16 -40.23 61.13 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.967 -1.083 . . . . 0.0 110.371 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -63.42 -55.05 27.42 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.181 -0.949 . . . . 0.0 109.069 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -60.25 -38.9 84.93 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.245 -0.909 . . . . 0.0 109.098 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -57.12 -38.84 74.02 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.156 -0.965 . . . . 0.0 109.849 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.436 HG12 ' CE1' ' A' ' 8' ' ' TYR . 72.3 t -60.15 -38.6 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.126 -0.984 . . . . 0.0 109.721 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -56.5 -49.24 75.3 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.988 -1.07 . . . . 0.0 109.445 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.72 -27.58 59.45 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.317 -0.865 . . . . 0.0 110.49 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -74.38 -50.59 17.98 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.904 -1.122 . . . . 0.0 110.548 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.441 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -99.53 34.43 2.22 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.016 -1.052 . . . . 0.0 111.552 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.4 tp60 -83.85 -40.47 18.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.726 -1.234 . . . . 0.0 109.824 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -115.02 29.43 8.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.264 -0.898 . . . . 0.0 110.83 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.3 t90 -51.27 -53.68 33.22 Favored 'General case' 0 N--CA 1.513 2.718 0 O-C-N 120.946 -1.096 . . . . 0.0 110.873 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.447 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 19.6 mtm -144.7 -71.1 0.28 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.0 110.448 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -172.64 45.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.928 -1.107 . . . . 0.0 111.126 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -165.31 -168.19 1.32 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.124 -0.985 . . . . 0.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -115.47 126.63 54.55 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.208 -0.933 . . . . 0.0 110.074 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -116.34 74.74 0.92 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.03 35.81 3.11 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.047 -1.033 . . . . 0.0 110.395 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -112.09 -53.56 2.7 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.148 -0.97 . . . . 0.0 109.843 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -20.85 63.4 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.188 -0.945 . . . . 0.0 111.545 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 46.8 mm -69.51 -47.61 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.677 -1.265 . . . . 0.0 109.58 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.5 -38.53 77.85 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.121 -0.987 . . . . 0.0 110.245 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -70.87 -35.31 72.32 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.13 -0.981 . . . . 0.0 110.417 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m -83.8 -39.73 19.63 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.004 -1.06 . . . . 0.0 110.174 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 p -59.39 -39.0 81.97 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.132 -0.98 . . . . 0.0 110.155 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.64 93.79 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.19 -0.944 . . . . 0.0 110.011 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.44 -38.11 65.92 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.058 -1.027 . . . . 0.0 110.605 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -55.55 -38.33 69.17 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.084 -1.01 . . . . 0.0 110.411 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 51.1 0.92 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.123 -0.985 . . . . 0.0 110.163 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 52.64 86.93 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.053 -1.029 . . . . 0.0 110.786 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.36 -49.11 1.6 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.0 tttm . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.22 -1.165 . . . . 0.0 110.188 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ttm . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.96 149.6 47.36 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.419 1.221 . . . . 0.0 110.517 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -138.56 151.87 47.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.189 -0.945 . . . . 0.0 110.015 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE2' ' NH2' ' A' ' 21' ' ' ARG . 37.2 t80 -115.85 156.2 26.53 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.189 -0.944 . . . . 0.0 109.912 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -140.52 140.5 35.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.156 -0.965 . . . . 0.0 110.442 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 t -113.17 98.54 7.2 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.251 -0.905 . . . . 0.0 109.99 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -56.47 -36.55 69.21 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.204 -0.935 . . . . 0.0 110.693 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.422 ' OH ' HD12 ' A' ' 50' ' ' ILE . 24.6 m-85 -62.5 -34.5 76.98 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.047 -1.033 . . . . 0.0 110.064 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.9 m -93.41 -3.18 53.67 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.055 -1.028 . . . . 0.0 112.004 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 53.98 38.73 29.48 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.4 -1.438 . . . . 0.0 110.457 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -134.66 171.68 14.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.265 -0.897 . . . . 0.0 109.86 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.09 120.54 32.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -83.0 162.05 21.56 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.12 -0.987 . . . . 0.0 109.493 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.413 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -101.09 -31.04 11.26 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.086 -1.009 . . . . 0.0 111.848 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.413 ' CD2' HG21 ' A' ' 14' ' ' THR . 42.4 m-70 -115.23 137.6 51.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.796 -1.19 . . . . 0.0 110.427 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -116.27 89.41 3.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.252 -0.905 . . . . 0.0 109.765 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.4 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -131.63 -179.99 1.2 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.857 . . . . 0.0 109.923 -179.568 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.33 -28.92 17.67 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.419 1.221 . . . . 0.0 111.093 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.9 t -92.27 -44.25 8.85 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.889 -1.132 . . . . 0.0 110.019 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.0 t -59.03 -52.23 63.16 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.052 -1.03 . . . . 0.0 109.825 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.449 ' NH2' ' CE2' ' A' ' 4' ' ' PHE . 24.9 mtp85 -58.49 -50.25 74.43 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.031 -1.043 . . . . 0.0 109.552 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -61.27 -39.9 92.12 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.186 -0.946 . . . . 0.0 108.881 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 79.5 m -54.03 -42.23 68.92 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.149 -0.969 . . . . 0.0 108.681 178.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.61 -39.58 94.74 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.2 t -93.9 57.3 2.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.304 -0.873 . . . . 0.0 110.084 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.5 m -113.06 37.87 3.01 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.104 -0.998 . . . . 0.0 110.557 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.28 126.55 1.99 Allowed Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.096 -1.201 . . . . 0.0 110.096 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -55.08 -28.19 50.54 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.058 -1.26 . . . . 0.0 110.165 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -57.8 -33.9 69.06 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.888 -1.133 . . . . 0.0 110.394 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -49.45 -43.94 45.24 Favored 'General case' 0 N--CA 1.515 2.812 0 O-C-N 120.991 -1.068 . . . . 0.0 110.86 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.9 tttt -60.79 -54.08 49.55 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.061 -1.024 . . . . 0.0 109.185 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -60.03 -38.44 82.73 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.211 -0.931 . . . . 0.0 109.088 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -56.51 -37.17 70.06 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.173 -0.954 . . . . 0.0 110.198 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 ' CG1' ' CD2' ' A' ' 8' ' ' TYR . 84.0 t -61.91 -37.34 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 121.082 -1.011 . . . . 0.0 110.066 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.3 mtpt -54.24 -41.78 69.14 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.901 -1.124 . . . . 0.0 109.73 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.91 -28.89 66.62 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.291 178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -71.18 -52.16 20.75 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.924 -1.11 . . . . 0.0 110.285 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.448 ' O ' ' CD1' ' A' ' 38' ' ' TYR . 37.9 p90 -100.09 35.8 1.99 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.079 -1.013 . . . . 0.0 111.263 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -37.9 14.28 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.85 -1.156 . . . . 0.0 110.151 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -112.87 27.82 9.31 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 111.165 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.0 t90 -70.18 -43.08 71.51 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.029 -1.045 . . . . 0.0 110.019 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.429 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -151.66 36.32 0.57 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.219 -0.926 . . . . 0.0 110.746 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 50.54 38.77 19.47 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.961 -1.087 . . . . 0.0 111.088 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -140.84 -173.94 3.85 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.139 -0.976 . . . . 0.0 110.304 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -112.77 116.69 30.48 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -115.77 73.47 0.84 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.201 -0.937 . . . . 0.0 110.221 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.74 36.76 2.32 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.082 -1.011 . . . . 0.0 110.205 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.8 p -113.08 -55.63 2.5 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.118 -0.989 . . . . 0.0 109.452 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -21.65 64.33 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.183 -0.948 . . . . 0.0 111.161 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.422 HD12 ' OH ' ' A' ' 8' ' ' TYR . 44.3 mm -66.79 -41.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.618 -1.301 . . . . 0.0 109.219 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.436 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 1.4 t70 -61.17 -41.73 97.3 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.606 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -59.97 -36.49 77.22 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.189 -0.944 . . . . 0.0 110.14 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.45 ' CG2' ' CE1' ' A' ' 57' ' ' PHE . 46.5 m -84.71 -40.36 17.43 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.041 -1.037 . . . . 0.0 109.998 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.436 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 38.2 p -68.36 -39.6 81.77 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.108 -0.995 . . . . 0.0 109.789 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.66 -35.55 68.53 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 110.434 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.89 -36.19 15.19 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.995 -1.066 . . . . 0.0 110.336 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE1' ' CG2' ' A' ' 53' ' ' THR . 2.4 m-85 -49.93 -35.23 23.16 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.061 -1.024 . . . . 0.0 111.038 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -109.41 -52.77 2.73 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.118 -0.989 . . . . 0.0 110.376 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -115.33 67.51 0.7 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.12 -0.988 . . . . 0.0 110.242 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.76 66.78 0.26 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.2 mttm . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.203 -1.175 . . . . 0.0 110.237 -179.99 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.403 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.215 0 CA-C-O 119.81 -0.138 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 1' ' ' MET . 49.7 Cg_endo -79.08 168.39 20.6 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 123.097 1.051 . . . . 0.0 110.288 -179.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 mttm 61.69 125.84 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.176 -0.953 . . . . 0.0 110.531 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.404 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 58.0 t80 -103.83 161.18 14.17 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.948 -1.095 . . . . 0.0 110.192 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -133.39 137.27 45.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.167 -0.958 . . . . 0.0 110.435 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.6 t -113.69 98.96 7.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.303 -0.873 . . . . 0.0 110.077 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -56.48 -36.83 69.55 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.105 -0.997 . . . . 0.0 110.256 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CD1' HG12 ' A' ' 34' ' ' VAL . 90.8 m-85 -59.7 -33.42 71.58 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 39.1 m -95.56 0.15 52.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.016 -1.052 . . . . 0.0 112.112 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 51.92 37.78 21.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.398 -1.439 . . . . 0.0 110.741 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -144.24 171.75 13.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.233 -0.917 . . . . 0.0 109.892 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.38 125.27 47.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 110.206 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.7 170.29 16.13 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.155 -0.966 . . . . 0.0 109.704 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.403 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -100.3 -31.8 11.17 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.217 -0.927 . . . . 0.0 111.681 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.403 ' CD2' HG21 ' A' ' 14' ' ' THR . 37.1 m-70 -116.54 142.21 47.17 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.83 -1.169 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -117.79 93.69 4.24 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 109.857 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.05 177.94 1.9 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 110.12 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.96 -31.11 15.69 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.426 1.224 . . . . 0.0 110.954 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.424 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -90.52 -41.77 11.21 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.021 -1.049 . . . . 0.0 110.002 179.548 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 97.2 t -59.31 -54.29 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 109.911 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 14.8 mtp-105 -56.56 -49.87 73.58 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.102 -0.999 . . . . 0.0 109.907 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -40.47 97.65 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.163 -1.015 . . . . 0.0 108.794 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.424 ' OG1' ' O ' ' A' ' 19' ' ' SER . 55.8 m -54.74 -42.68 71.9 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.08 -1.013 . . . . 0.0 108.423 178.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -62.36 -35.76 80.12 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.256 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -100.62 42.8 1.09 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.096 -1.003 . . . . 0.0 110.479 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -115.34 38.42 3.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.203 -0.936 . . . . 0.0 110.213 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.75 128.37 3.45 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -54.11 -28.7 41.29 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.227 -1.161 . . . . 0.0 110.359 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -59.24 -35.38 73.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.973 -1.079 . . . . 0.0 110.397 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -51.83 -39.04 58.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.91 -1.119 . . . . 0.0 110.473 -179.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -62.19 -53.7 51.55 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.092 -1.005 . . . . 0.0 109.037 179.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -60.63 -39.22 87.42 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.037 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -56.26 -38.74 71.55 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' A' ' 8' ' ' TYR . 79.0 t -58.89 -38.95 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.55 0 O-C-N 121.042 -1.036 . . . . 0.0 109.597 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 1.2 tmmt? -54.47 -39.97 67.98 Favored 'General case' 0 N--CA 1.513 2.705 0 O-C-N 121.028 -1.045 . . . . 0.0 109.618 179.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.75 -33.14 69.94 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.37 -53.65 45.25 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.033 -1.042 . . . . 0.0 109.621 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.442 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 45.9 p90 -100.73 35.29 2.2 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.203 -0.936 . . . . 0.0 110.922 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.45 -35.91 53.48 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.753 -1.217 . . . . 0.0 110.293 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -102.27 21.21 15.39 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.063 -1.023 . . . . 0.0 111.402 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.432 ' CZ2' ' HE2' ' A' ' 42' ' ' MET . 8.2 t90 -106.93 -52.8 2.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.88 -1.138 . . . . 0.0 109.827 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.432 ' HE2' ' CZ2' ' A' ' 41' ' ' TRP . 2.7 mtm -142.03 54.46 1.47 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.28 -0.888 . . . . 0.0 109.817 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -50.27 -34.99 25.25 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.121 -0.987 . . . . 0.0 111.272 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.2 -61.96 1.94 Allowed 'General case' 0 N--CA 1.513 2.705 0 O-C-N 120.937 -1.102 . . . . 0.0 110.585 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -147.75 96.62 2.7 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.423 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.79 71.51 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.229 -0.919 . . . . 0.0 110.486 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 35.15 2.33 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.15 -0.969 . . . . 0.0 110.482 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.02 -52.88 2.71 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.061 -1.024 . . . . 0.0 109.578 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -20.93 64.1 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.262 -0.898 . . . . 0.0 111.334 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.441 HG21 HD11 ' A' ' 50' ' ' ILE . 49.1 mm -75.13 -39.99 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 120.622 -1.299 . . . . 0.0 109.847 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.419 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 1.4 m-20 -75.76 -40.38 55.47 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.095 -1.003 . . . . 0.0 110.004 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt -57.42 -34.74 69.24 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.164 -0.96 . . . . 0.0 110.635 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.7 m -90.45 -38.66 13.11 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.021 -1.05 . . . . 0.0 110.247 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.419 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 62.8 p -71.68 -34.79 69.99 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.077 -1.014 . . . . 0.0 110.401 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.93 -39.65 12.15 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.998 -1.064 . . . . 0.0 110.263 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.73 51.83 1.3 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.136 -0.978 . . . . 0.0 110.499 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -92.91 -59.49 2.04 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -149.05 51.63 0.97 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.198 -0.939 . . . . 0.0 110.484 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -119.4 -57.78 1.97 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.172 -0.955 . . . . 0.0 110.309 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -142.94 -61.07 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tttm . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.201 -1.176 . . . . 0.0 110.228 -179.95 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 mtm . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.71 115.93 4.53 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.442 1.233 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.454 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 42.8 mttt -127.55 152.31 47.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -109.65 161.98 14.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.167 -179.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -129.36 138.24 51.42 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.113 -0.992 . . . . 0.0 110.37 -179.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 47.4 t -117.11 96.77 5.59 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.17 -0.956 . . . . 0.0 109.967 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -51.88 -35.98 47.03 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.021 -1.05 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.436 ' CE1' HG12 ' A' ' 34' ' ' VAL . 76.9 m-85 -62.81 -31.19 72.13 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.186 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.0 m -98.02 -9.45 26.02 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.008 -1.058 . . . . 0.0 111.965 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.1 t70 56.34 41.22 29.33 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.382 -1.449 . . . . 0.0 110.014 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -146.21 174.26 11.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.281 -0.887 . . . . 0.0 110.191 -179.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.454 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.68 138.84 51.73 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.3 -0.875 . . . . 0.0 110.623 -179.686 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.4 mp -93.79 171.31 8.95 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.137 -0.977 . . . . 0.0 109.735 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -96.67 -30.2 13.38 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.26 -0.9 . . . . 0.0 111.368 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' HG21 ' A' ' 14' ' ' THR . 49.6 m-70 -113.21 148.26 35.84 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.823 -1.173 . . . . 0.0 110.188 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -126.65 96.3 4.62 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.255 -0.903 . . . . 0.0 109.845 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -152.23 178.1 1.68 Allowed Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.234 -0.916 . . . . 0.0 110.456 -179.712 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.0 Cg_endo -70.72 -33.64 12.63 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.296 1.156 . . . . 0.0 110.74 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.7 m -84.65 -37.09 21.47 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.007 -1.058 . . . . 0.0 110.142 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.9 t -64.51 -45.81 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.084 -1.01 . . . . 0.0 109.438 179.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -57.27 -50.77 71.84 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.992 -1.067 . . . . 0.0 109.571 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.65 -41.4 97.46 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.69 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.4 m -54.6 -43.43 72.15 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.18 -0.95 . . . . 0.0 108.612 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -61.13 -37.61 83.41 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.452 -0.78 . . . . 0.0 109.109 178.081 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.5 t -94.21 54.65 1.91 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.119 -0.988 . . . . 0.0 110.386 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.12 38.98 3.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.087 -1.008 . . . . 0.0 110.049 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.59 163.43 23.25 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -88.96 -12.49 41.42 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.323 -1.104 . . . . 0.0 110.901 178.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.1 mmtm -91.11 -26.64 19.03 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.634 -1.291 . . . . 0.0 111.177 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -49.37 -38.66 29.3 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.836 -1.165 . . . . 0.0 110.751 -179.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -64.83 -53.44 46.77 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.216 -0.994 . . . . 0.0 108.981 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -61.09 -39.5 90.17 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.181 -0.949 . . . . 0.0 109.028 178.553 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -56.27 -37.98 70.56 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.137 -0.977 . . . . 0.0 110.055 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.436 HG12 ' CE1' ' A' ' 8' ' ' TYR . 64.4 t -59.74 -38.28 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 O-C-N 121.113 -0.992 . . . . 0.0 109.84 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -55.11 -40.69 70.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.912 -1.118 . . . . 0.0 109.782 179.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -58.36 -32.14 68.28 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.303 -0.873 . . . . 0.0 110.133 179.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -65.31 -52.84 51.44 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.965 -1.085 . . . . 0.0 110.116 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.9 p90 -100.55 35.5 2.12 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.082 -1.011 . . . . 0.0 111.061 179.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -81.63 -37.73 27.08 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.727 -1.233 . . . . 0.0 110.297 179.205 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -112.73 21.42 15.57 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.207 -0.933 . . . . 0.0 111.587 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 17.8 t90 -61.08 -46.49 90.45 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.809 -1.182 . . . . 0.0 109.858 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.6 mtm -152.65 36.24 0.5 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.211 -0.93 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.65 46.47 25.67 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.939 -1.101 . . . . 0.0 111.055 179.769 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -146.33 -172.3 3.92 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.107 -0.996 . . . . 0.0 110.374 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -110.86 162.95 14.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.155 -0.966 . . . . 0.0 109.999 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -168.75 77.57 0.12 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.167 -0.958 . . . . 0.0 111.164 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -109.85 34.5 3.81 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.058 -1.026 . . . . 0.0 110.433 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.03 -57.71 2.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.182 -0.949 . . . . 0.0 109.101 179.251 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 pp -54.33 -26.34 29.1 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.195 -0.941 . . . . 0.0 111.271 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.437 HD11 HG22 ' A' ' 50' ' ' ILE . 41.5 mm -61.15 -41.51 89.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 120.646 -1.284 . . . . 0.0 109.483 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -36.29 79.53 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.229 -0.919 . . . . 0.0 110.753 -179.62 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.51 -39.61 11.84 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.059 -1.026 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -61.99 -39.75 93.27 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.154 -0.966 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.8 p -57.18 -38.18 73.22 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.131 -0.98 . . . . 0.0 110.48 -179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.03 -40.08 11.28 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.141 -0.974 . . . . 0.0 110.153 179.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.84 54.56 1.75 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.116 -0.99 . . . . 0.0 110.337 179.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -93.05 -39.42 11.09 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.13 -0.981 . . . . 0.0 110.28 179.723 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -114.47 66.59 0.68 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.153 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -134.28 -59.2 0.83 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -131.76 64.82 0.6 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.2 mttm . . . . . 0 N--CA 1.502 2.159 0 O-C-N 121.125 -1.221 . . . . 0.0 110.778 -179.991 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mtp . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 112.44 3.52 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.44 1.232 . . . . 0.0 110.47 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.409 ' HE3' ' OG1' ' A' ' 14' ' ' THR . 23.8 mttp -146.61 154.2 41.22 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.24 -0.913 . . . . 0.0 110.413 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.445 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 43.1 t80 -110.21 156.04 21.19 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.202 -0.936 . . . . 0.0 109.886 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -138.38 136.8 36.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.608 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 t -110.6 93.45 4.5 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.2 -0.938 . . . . 0.0 110.089 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -52.23 -36.23 51.82 Favored 'General case' 0 N--CA 1.513 2.703 0 O-C-N 121.072 -1.017 . . . . 0.0 110.515 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE1' HG12 ' A' ' 34' ' ' VAL . 87.5 m-85 -60.34 -32.58 71.39 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.133 -0.98 . . . . 0.0 110.025 178.979 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.1 m -97.45 -0.52 46.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.057 -1.027 . . . . 0.0 112.162 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 t70 52.73 38.93 27.62 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.383 -1.448 . . . . 0.0 110.599 -179.709 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -137.56 172.76 12.49 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.286 -0.884 . . . . 0.0 110.021 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.0 120.17 32.57 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.31 -0.869 . . . . 0.0 110.131 -179.759 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -82.17 146.34 29.61 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.193 -0.942 . . . . 0.0 109.612 179.472 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.409 ' OG1' ' HE3' ' A' ' 3' ' ' LYS . 14.1 t -104.06 -20.55 13.81 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.073 -1.017 . . . . 0.0 112.62 -179.35 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 27.7 m-70 -106.16 70.44 0.84 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.587 -1.32 . . . . 0.0 110.301 -179.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -61.11 101.78 0.17 Allowed 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.197 -0.939 . . . . 0.0 109.874 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.22 176.63 2.12 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.022 -1.049 . . . . 0.0 110.314 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.83 -31.86 15.07 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.519 1.273 . . . . 0.0 110.89 179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.416 ' O ' ' OG1' ' A' ' 23' ' ' THR . 23.5 m -91.1 -39.78 11.97 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.953 -1.092 . . . . 0.0 110.222 179.605 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.0 t -60.01 -49.18 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.568 0 O-C-N 121.155 -0.966 . . . . 0.0 109.663 179.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.445 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 16.5 mtp180 -58.56 -51.73 68.64 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.079 -1.013 . . . . 0.0 109.609 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -40.6 97.6 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.262 -0.975 . . . . 0.0 108.818 179.014 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 19' ' ' SER . 93.8 m -56.0 -42.88 77.08 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.077 -1.014 . . . . 0.0 108.37 178.316 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -63.53 -36.38 83.59 Favored 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.152 178.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 t -100.16 43.85 1.04 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.138 -0.976 . . . . 0.0 110.473 -179.671 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.77 38.49 3.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.182 -0.949 . . . . 0.0 110.138 179.773 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.95 127.32 2.97 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -54.63 -28.33 46.07 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.087 -1.243 . . . . 0.0 110.226 178.955 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -58.92 -33.63 70.79 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.991 -1.068 . . . . 0.0 110.681 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.0 t-80 -50.84 -38.44 49.01 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.876 -1.14 . . . . 0.0 110.705 -179.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -63.65 -53.03 57.83 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.135 -0.978 . . . . 0.0 108.942 179.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.98 -39.89 91.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.239 -0.913 . . . . 0.0 108.944 178.642 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -56.11 -38.12 70.34 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.211 -0.931 . . . . 0.0 110.083 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE1' ' A' ' 8' ' ' TYR . 79.3 t -57.58 -36.8 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.069 -1.019 . . . . 0.0 110.032 179.626 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.9 tttt -53.02 -40.96 64.24 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.924 -1.11 . . . . 0.0 109.892 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -58.79 -29.67 67.0 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.223 178.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -68.55 -52.4 32.28 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.976 -1.078 . . . . 0.0 110.257 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 43.4 p90 -100.09 33.58 2.58 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.004 -1.06 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.46 -64.71 1.11 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.791 -1.193 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tptm -64.42 -34.64 78.65 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.304 -0.873 . . . . 0.0 110.086 179.421 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 8.5 t90 -52.52 -48.07 66.28 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.041 -1.037 . . . . 0.0 111.278 -179.453 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -105.82 -45.22 4.44 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.02 -1.05 . . . . 0.0 111.26 -179.308 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 53.4 37.63 25.97 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.974 -1.079 . . . . 0.0 110.704 -179.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -160.75 -66.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.222 -0.924 . . . . 0.0 110.83 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -158.54 104.87 1.82 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.264 -0.897 . . . . 0.0 110.809 -179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -145.79 70.67 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.24 -0.912 . . . . 0.0 110.326 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -120.46 36.76 4.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.373 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.7 -53.71 2.67 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.195 -0.941 . . . . 0.0 109.654 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.35 -21.05 63.66 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.196 -0.94 . . . . 0.0 111.464 179.537 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.42 HD13 ' CD1' ' A' ' 38' ' ' TYR . 48.5 mm -72.61 -40.1 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 120.626 -1.296 . . . . 0.0 109.777 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.42 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 7.1 m-20 -65.67 -40.15 92.11 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.124 -0.985 . . . . 0.0 109.971 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -64.18 -35.2 80.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.136 -0.977 . . . . 0.0 110.502 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.7 m -87.64 -40.42 14.2 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.008 -1.057 . . . . 0.0 110.131 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.42 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 18.8 p -59.11 -36.41 75.12 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.158 -0.964 . . . . 0.0 110.289 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.81 -43.93 9.74 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.062 -1.023 . . . . 0.0 110.003 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -93.75 58.64 2.7 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -92.59 11.61 25.95 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.241 -0.912 . . . . 0.0 112.098 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 54.63 93.45 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.433 -1.417 . . . . 0.0 110.433 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -87.72 -39.57 14.85 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.335 -0.853 . . . . 0.0 110.115 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.82 -110.35 3.47 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.894 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt . . . . . 0 N--CA 1.499 2.013 0 O-C-N 121.164 -1.198 . . . . 0.0 110.766 -179.979 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.7 mtt . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.52 101.55 1.28 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.39 1.205 . . . . 0.0 110.349 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.7 mtmm -120.28 146.35 46.18 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.177 -0.952 . . . . 0.0 110.276 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.441 ' CE1' ' NH1' ' A' ' 21' ' ' ARG . 42.3 t80 -114.75 156.43 24.84 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.965 . . . . 0.0 109.921 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -136.08 135.94 39.77 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.104 -0.997 . . . . 0.0 110.561 -179.733 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 t -111.63 93.82 4.66 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.224 -0.922 . . . . 0.0 110.202 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -52.64 -35.85 55.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.115 -0.991 . . . . 0.0 110.379 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 34' ' ' VAL . 79.7 m-85 -60.86 -32.85 72.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.176 -0.952 . . . . 0.0 110.098 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.3 m -96.95 -0.71 47.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.991 -1.068 . . . . 0.0 112.084 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t70 53.07 38.64 27.88 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.367 -1.458 . . . . 0.0 110.656 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -139.43 171.68 13.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.147 -0.971 . . . . 0.0 110.036 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.17 120.39 34.08 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.184 -0.947 . . . . 0.0 110.032 -179.66 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -78.25 166.14 23.06 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.161 -0.962 . . . . 0.0 109.558 179.43 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 t -102.22 -30.43 11.11 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.085 -1.009 . . . . 0.0 112.013 -179.367 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.5 m-70 -113.72 139.78 48.8 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.682 -1.261 . . . . 0.0 110.5 -179.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -116.13 94.98 4.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.359 -0.838 . . . . 0.0 109.765 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.24 176.53 2.25 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.234 -0.916 . . . . 0.0 110.169 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.49 -30.33 23.71 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 O-C-N 123.386 1.203 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' OG1' ' A' ' 23' ' ' THR . 4.5 t -88.01 -41.47 13.09 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.931 -1.105 . . . . 0.0 109.974 179.65 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.3 t -59.82 -50.47 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.187 -0.946 . . . . 0.0 109.787 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' NH1' ' CE1' ' A' ' 4' ' ' PHE . 19.4 mtt180 -58.06 -51.73 68.46 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.053 -1.029 . . . . 0.0 109.611 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -60.85 -40.58 93.43 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.958 178.848 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 19' ' ' SER . 97.0 m -55.36 -43.04 74.7 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 121.145 -0.972 . . . . 0.0 108.507 178.316 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -64.37 -39.71 94.4 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.425 -0.797 . . . . 0.0 108.95 178.148 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.17 56.53 2.54 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.145 -0.972 . . . . 0.0 110.274 -179.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 37.86 3.57 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.049 -1.032 . . . . 0.0 110.403 179.815 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.49 125.2 2.01 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -54.71 -27.96 44.5 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.174 -1.192 . . . . 0.0 110.359 179.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 tptt -60.62 -31.78 70.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.933 -1.104 . . . . 0.0 110.764 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -49.83 -42.59 47.61 Favored 'General case' 0 N--CA 1.517 2.892 0 O-C-N 120.884 -1.135 . . . . 0.0 110.865 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -62.7 -52.56 62.81 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.116 -0.99 . . . . 0.0 109.109 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -61.4 -40.23 93.62 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.194 -0.941 . . . . 0.0 108.894 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -56.27 -37.94 70.5 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.324 -0.86 . . . . 0.0 109.914 179.083 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 8' ' ' TYR . 78.2 t -55.95 -34.52 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.602 0 O-C-N 121.05 -1.031 . . . . 0.0 110.141 179.632 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -54.82 -42.92 72.47 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.858 -1.151 . . . . 0.0 109.763 179.421 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.39 -27.97 64.76 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 178.904 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.03 -52.08 26.98 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.891 -1.131 . . . . 0.0 110.325 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 40.6 p90 -99.69 32.53 2.82 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.991 -1.068 . . . . 0.0 111.404 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -82.49 -38.46 23.85 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.728 -1.233 . . . . 0.0 109.805 178.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.5 tttp -109.28 31.35 5.81 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.234 -0.916 . . . . 0.0 110.548 179.261 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.466 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 7.8 t90 -85.84 -40.49 15.92 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.062 -1.024 . . . . 0.0 110.134 -179.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.466 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 14.8 ptp -176.59 -43.69 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.139 -0.976 . . . . 0.0 112.038 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -116.62 176.8 4.95 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.677 -1.264 . . . . 0.0 110.452 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -101.12 -42.72 6.26 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.277 -0.89 . . . . 0.0 110.594 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -105.04 83.49 1.99 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.039 -1.038 . . . . 0.0 110.198 179.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -117.13 75.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.204 -0.935 . . . . 0.0 110.107 -179.99 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.44 35.63 3.11 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 110.461 179.598 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -110.29 -54.31 2.59 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.126 -0.984 . . . . 0.0 109.401 179.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -20.96 64.21 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.203 -0.936 . . . . 0.0 111.297 179.18 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.43 HD11 HG22 ' A' ' 50' ' ' ILE . 47.6 mm -71.81 -46.32 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.646 -1.284 . . . . 0.0 109.446 179.615 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.406 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 14.9 t70 -60.56 -38.47 84.65 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.236 -0.915 . . . . 0.0 110.028 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -35.06 64.89 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.045 -1.034 . . . . 0.0 110.659 -179.855 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m -91.47 -38.7 12.39 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.041 -1.037 . . . . 0.0 110.303 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.406 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 82.7 p -74.64 -34.52 62.77 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.071 -1.018 . . . . 0.0 110.461 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.99 -38.17 13.82 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.972 -1.08 . . . . 0.0 110.178 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.15 46.14 1.04 Allowed 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.002 -1.061 . . . . 0.0 110.665 179.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.63 -59.05 2.16 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.153 -0.967 . . . . 0.0 110.134 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -146.8 71.47 1.23 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.192 -0.943 . . . . 0.0 110.486 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -145.43 82.31 1.64 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.087 -1.008 . . . . 0.0 110.338 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -87.11 -99.7 0.84 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.451 -1.459 . . . . 0.0 109.451 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.0 tptm . . . . . 0 N--CA 1.493 1.705 0 O-C-N 121.158 -1.201 . . . . 0.0 110.203 179.987 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.79 140.85 32.8 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.449 1.236 . . . . 0.0 110.408 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.413 ' CB ' ' CE2' ' A' ' 12' ' ' TYR . 25.4 mttt -129.55 154.25 47.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.227 -0.921 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CE2' ' HD3' ' A' ' 21' ' ' ARG . 69.8 t80 -112.78 162.01 16.25 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -131.08 136.74 48.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.466 -179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.3 t -116.16 98.37 6.58 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.264 -0.898 . . . . 0.0 109.826 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -51.82 -35.92 46.05 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.015 -1.053 . . . . 0.0 110.782 -179.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CD2' HG12 ' A' ' 34' ' ' VAL . 78.9 m-85 -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.088 -1.008 . . . . 0.0 110.291 179.4 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.0 m -97.29 -10.49 25.6 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.097 -1.002 . . . . 0.0 111.881 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 55.91 40.78 30.48 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.462 -1.399 . . . . 0.0 110.172 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -142.11 170.72 15.19 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.22 -0.925 . . . . 0.0 109.984 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.413 ' CE2' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.17 125.21 50.84 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.265 -0.897 . . . . 0.0 110.398 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -80.61 170.68 16.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.203 -0.936 . . . . 0.0 109.72 179.67 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.411 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.1 t -96.91 -30.49 13.09 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.204 -0.935 . . . . 0.0 111.334 -179.793 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.411 ' CD2' HG21 ' A' ' 14' ' ' THR . 47.5 m-70 -113.69 146.44 39.82 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.875 -1.141 . . . . 0.0 110.205 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -125.95 93.52 3.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.123 -0.985 . . . . 0.0 109.727 179.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -146.73 179.75 1.11 Allowed Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.511 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -71.75 -32.12 12.1 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.341 1.18 . . . . 0.0 110.935 179.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.402 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.8 OUTLIER -86.06 -39.21 17.03 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.949 -1.094 . . . . 0.0 109.95 179.476 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.61 -47.48 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.12 -0.987 . . . . 0.0 109.609 179.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HD3' ' CE2' ' A' ' 4' ' ' PHE . 23.9 mtt180 -57.62 -52.58 64.82 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.038 -1.039 . . . . 0.0 109.714 179.765 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -60.03 -39.84 87.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.128 -0.982 . . . . 0.0 108.943 178.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.3 m -55.08 -43.78 74.26 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.051 -1.031 . . . . 0.0 108.4 178.267 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -62.25 -37.46 85.53 Favored 'General case' 0 N--CA 1.504 2.252 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.34 48.46 0.99 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.216 -0.927 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.05 38.27 3.23 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.087 -1.008 . . . . 0.0 110.245 179.805 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.89 127.66 2.86 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -54.21 -28.52 41.52 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.106 -1.232 . . . . 0.0 110.32 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -58.68 -35.5 72.7 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.058 -1.026 . . . . 0.0 110.462 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.0 t-80 -51.74 -40.7 60.7 Favored 'General case' 0 N--CA 1.515 2.788 0 O-C-N 121.03 -1.044 . . . . 0.0 110.427 -179.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -63.06 -52.22 63.61 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.123 -0.986 . . . . 0.0 108.819 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.65 -39.92 93.06 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.185 -0.947 . . . . 0.0 108.868 178.507 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -56.21 -38.58 71.22 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.961 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.433 HG12 ' CD2' ' A' ' 8' ' ' TYR . 70.6 t -58.56 -38.89 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.125 -0.984 . . . . 0.0 109.712 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.6 mtmp? -57.29 -44.83 84.37 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.059 -1.025 . . . . 0.0 109.261 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.7 -31.81 64.85 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.339 -0.851 . . . . 0.0 110.051 178.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -64.07 -53.16 54.19 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.98 -1.075 . . . . 0.0 109.769 179.729 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 45.2 p90 -99.69 28.03 4.98 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.111 -0.993 . . . . 0.0 111.602 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -56.45 -41.0 75.74 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.637 -1.29 . . . . 0.0 110.064 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -126.94 28.42 5.81 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.248 -0.908 . . . . 0.0 111.199 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 17.1 t90 -52.59 -36.28 55.82 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.903 -1.123 . . . . 0.0 110.805 -179.72 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.454 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -138.35 -67.71 0.46 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.143 -0.973 . . . . 0.0 110.398 179.908 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -170.93 -52.01 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.092 -1.005 . . . . 0.0 111.138 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.08 -168.83 2.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.224 -0.922 . . . . 0.0 109.771 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -95.62 144.51 26.0 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.088 -1.008 . . . . 0.0 110.25 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.64 84.52 2.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.224 -0.923 . . . . 0.0 110.333 -179.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -105.49 34.39 3.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 110.598 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.8 p -112.5 -55.04 2.56 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.112 -0.993 . . . . 0.0 109.314 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.06 -21.62 61.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.3 -0.875 . . . . 0.0 111.403 179.225 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.403 HD11 HG22 ' A' ' 50' ' ' ILE . 46.4 mm -68.93 -48.38 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.58 -1.325 . . . . 0.0 109.395 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.428 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -58.99 -39.18 80.99 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.165 -0.96 . . . . 0.0 110.191 -179.912 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -56.48 -36.61 69.31 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.211 -0.931 . . . . 0.0 110.72 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.8 m -91.69 -46.92 7.65 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.096 -1.002 . . . . 0.0 110.406 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 48.1 p -57.84 -36.45 72.31 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.143 -0.973 . . . . 0.0 110.595 -179.785 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.13 -41.07 23.02 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.063 -1.023 . . . . 0.0 109.928 179.756 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.13 48.96 1.05 Allowed 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.212 -0.93 . . . . 0.0 110.485 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -92.73 -58.79 2.24 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.14 -0.975 . . . . 0.0 110.323 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -120.64 -58.26 1.84 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.176 -0.952 . . . . 0.0 110.399 -179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -116.99 67.85 0.74 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.82 -41.26 19.51 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 ttmt . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.157 179.961 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.0 147.99 44.35 Favored 'Trans proline' 0 C--N 1.316 -1.137 0 O-C-N 123.396 1.209 . . . . 0.0 110.448 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -141.28 156.69 45.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.279 -0.888 . . . . 0.0 110.047 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -110.85 161.5 15.74 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.14 -0.975 . . . . 0.0 110.188 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -137.4 133.26 34.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.914 . . . . 0.0 110.194 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.1 t -113.91 94.64 4.92 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.118 -0.989 . . . . 0.0 110.173 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -52.85 -35.9 58.12 Favored 'General case' 0 N--CA 1.513 2.689 0 O-C-N 121.025 -1.047 . . . . 0.0 110.478 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CE2' HG12 ' A' ' 34' ' ' VAL . 82.0 m-85 -60.59 -32.91 71.99 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.159 -0.963 . . . . 0.0 110.106 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.9 m -96.63 -3.89 42.0 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.063 -1.023 . . . . 0.0 112.181 -179.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 t70 53.69 39.12 29.8 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.383 -1.448 . . . . 0.0 110.458 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -141.98 170.72 15.18 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.217 -0.927 . . . . 0.0 109.914 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -119.49 136.74 54.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 mp -96.26 161.88 13.76 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.267 -0.895 . . . . 0.0 109.578 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 t -98.57 -21.81 16.29 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.076 -1.015 . . . . 0.0 111.81 -179.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 51.6 m-70 -114.37 143.99 44.0 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.709 -1.245 . . . . 0.0 110.022 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -125.67 92.54 3.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 109.715 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.43 177.9 1.62 Allowed Pre-proline 0 N--CA 1.496 1.868 0 O-C-N 121.279 -0.888 . . . . 0.0 110.214 -179.518 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -70.51 -33.26 14.04 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.395 1.208 . . . . 0.0 110.775 179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 44.5 m -84.2 -39.2 19.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.956 -1.09 . . . . 0.0 110.035 179.569 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.1 t -64.38 -45.93 94.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.061 -1.024 . . . . 0.0 109.451 179.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 -59.71 -52.28 66.17 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.175 -0.953 . . . . 0.0 109.351 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -59.55 -39.67 84.74 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.137 -0.977 . . . . 0.0 108.908 178.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.4 m -55.39 -43.68 75.41 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.143 -0.973 . . . . 0.0 108.406 178.318 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.49 -40.4 96.99 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 t -92.5 56.95 2.84 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.285 -0.884 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.36 37.9 3.4 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.086 -1.009 . . . . 0.0 110.378 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.43 123.68 1.6 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -29.65 29.7 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.104 -1.233 . . . . 0.0 110.192 178.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.2 ptpt -57.12 -32.87 66.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.724 179.781 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -49.82 -41.76 45.54 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.978 -1.076 . . . . 0.0 110.737 -179.612 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -62.68 -54.45 39.11 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.16 -0.962 . . . . 0.0 108.986 179.167 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.43 -39.67 88.27 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.108 178.713 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -56.76 -37.6 71.27 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.227 -0.921 . . . . 0.0 110.018 179.118 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.43 HG12 ' CE2' ' A' ' 8' ' ' TYR . 73.5 t -56.67 -35.95 47.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.041 -1.037 . . . . 0.0 110.268 179.71 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.7 ttmm -57.35 -44.89 84.69 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.86 -1.15 . . . . 0.0 109.677 179.357 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.29 -25.13 63.86 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.479 178.966 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.41 -50.44 15.86 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.832 -1.167 . . . . 0.0 110.676 -179.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.458 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 34.5 p90 -99.49 32.96 2.61 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.976 -1.077 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -83.97 -38.43 20.99 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.715 -1.24 . . . . 0.0 109.927 178.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -112.01 32.21 5.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.117 -0.989 . . . . 0.0 110.583 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.6 t90 -90.82 -39.2 12.49 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.152 -0.968 . . . . 0.0 110.094 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -150.58 -63.26 0.2 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.224 -0.923 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -140.47 -171.67 3.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.56 39.3 2.13 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.173 -0.955 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -147.37 74.71 1.34 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.229 -0.92 . . . . 0.0 110.241 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -142.74 72.49 1.37 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.248 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 36.36 3.89 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.284 -0.885 . . . . 0.0 110.322 179.643 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -111.04 -54.9 2.56 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -20.17 65.29 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.24 -0.912 . . . . 0.0 111.285 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG21 HD11 ' A' ' 50' ' ' ILE . 49.1 mm -72.79 -52.95 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 O-C-N 120.719 -1.238 . . . . 0.0 109.705 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.63 -40.25 86.99 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.197 -0.939 . . . . 0.0 110.075 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 tptp -56.21 -32.23 64.21 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.075 -1.015 . . . . 0.0 110.802 -179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 m -85.2 -34.5 22.02 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.961 -1.087 . . . . 0.0 110.816 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 81.0 p -85.37 -41.98 14.96 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.969 -1.082 . . . . 0.0 110.001 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.81 71.66 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.192 -0.943 . . . . 0.0 110.485 179.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.99 -32.49 16.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.013 -1.054 . . . . 0.0 110.878 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.42 -37.87 27.07 Favored 'General case' 0 N--CA 1.519 2.983 0 O-C-N 120.955 -1.09 . . . . 0.0 110.843 -179.615 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -118.33 -68.23 0.93 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.143 -0.973 . . . . 0.0 110.306 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -170.6 -60.64 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.14 -0.975 . . . . 0.0 110.865 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -148.35 -76.43 0.02 OUTLIER Glycine 0 N--CA 1.495 2.618 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.995 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.283 -1.128 . . . . 0.0 110.226 179.966 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.5 mtt . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.99 124.42 9.6 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 O-C-N 123.397 1.209 . . . . 0.0 110.499 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -119.4 163.29 17.44 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.239 -0.913 . . . . 0.0 109.992 179.904 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -115.48 162.12 17.63 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.186 -0.946 . . . . 0.0 110.101 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -140.12 132.51 28.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.157 -0.965 . . . . 0.0 110.284 -179.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.4 t -113.66 90.09 3.25 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.21 -0.932 . . . . 0.0 109.967 179.403 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -51.65 -35.75 43.37 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.029 -1.044 . . . . 0.0 110.348 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.442 ' CD2' ' CG1' ' A' ' 34' ' ' VAL . 87.1 m-85 -59.56 -31.65 69.63 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.978 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.8 m -98.24 0.02 44.92 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.016 -1.053 . . . . 0.0 112.258 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t0 52.63 38.9 27.2 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.381 -1.45 . . . . 0.0 110.666 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -143.21 172.15 13.12 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.32 -0.862 . . . . 0.0 110.029 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -123.6 139.73 53.71 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.287 -0.883 . . . . 0.0 110.871 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -100.44 163.09 12.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.264 -0.897 . . . . 0.0 109.36 179.314 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.72 -30.91 11.46 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.064 -1.022 . . . . 0.0 111.849 -179.247 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.415 ' CD2' HG21 ' A' ' 14' ' ' THR . 47.9 m-70 -113.02 134.89 54.31 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.792 -1.193 . . . . 0.0 110.3 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -115.39 82.43 1.75 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.178 -0.951 . . . . 0.0 109.776 179.731 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.32 -179.93 1.03 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.288 -0.882 . . . . 0.0 110.008 -179.658 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -71.24 -29.37 17.32 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.364 1.192 . . . . 0.0 111.099 179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.9 t -88.84 -46.31 9.04 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.867 -1.145 . . . . 0.0 110.033 179.546 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.2 t -58.55 -55.09 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.133 -0.98 . . . . 0.0 109.98 179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -55.55 -50.83 68.99 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.067 -1.021 . . . . 0.0 109.85 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.5 mttm -61.88 -39.85 93.34 Favored 'General case' 0 N--CA 1.506 2.36 0 C-N-CA 119.298 -0.961 . . . . 0.0 108.867 178.781 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 19' ' ' SER . 74.0 m -54.88 -42.95 72.71 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.11 -0.994 . . . . 0.0 108.433 178.267 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -62.25 -39.51 93.1 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.887 178.119 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.423 ' CB ' ' CE1' ' A' ' 57' ' ' PHE . 5.4 t -94.7 53.22 1.6 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.287 -0.883 . . . . 0.0 110.417 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.34 39.83 3.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.088 -1.008 . . . . 0.0 109.992 179.648 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.13 154.07 21.44 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -83.83 -10.26 58.17 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.327 -1.102 . . . . 0.0 111.074 178.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttm -90.51 -24.36 20.67 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.696 -1.253 . . . . 0.0 111.115 179.471 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -48.63 -38.75 21.86 Favored 'General case' 0 N--CA 1.517 2.911 0 O-C-N 120.767 -1.208 . . . . 0.0 110.853 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -65.53 -53.78 37.36 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.275 -0.97 . . . . 0.0 108.83 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.29 -39.33 90.05 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.17 -0.956 . . . . 0.0 108.981 178.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -56.66 -37.16 70.43 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.21 -0.931 . . . . 0.0 110.167 179.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.442 ' CG1' ' CD2' ' A' ' 8' ' ' TYR . 58.0 t -58.62 -43.4 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.024 -1.047 . . . . 0.0 109.726 179.837 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 24.1 ttmt -62.32 -43.25 99.25 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.986 179.086 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -60.61 -24.43 65.49 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.295 178.625 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -75.81 -51.83 11.73 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.764 -1.21 . . . . 0.0 110.452 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 32.8 p90 -98.94 28.99 4.02 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.002 -1.061 . . . . 0.0 111.643 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.08 -41.41 97.32 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.66 -1.275 . . . . 0.0 109.664 179.299 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -117.49 25.91 10.09 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.362 -0.836 . . . . 0.0 111.162 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.415 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.2 t90 -56.87 -39.25 73.98 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.963 -1.085 . . . . 0.0 110.344 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.415 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.2 ttm -147.03 33.55 0.91 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 49.79 37.59 13.64 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.955 -1.091 . . . . 0.0 111.258 179.692 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -145.01 -171.64 3.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.157 -0.964 . . . . 0.0 110.408 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -111.02 128.42 55.85 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.186 -0.946 . . . . 0.0 110.057 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.4 75.82 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.286 -0.884 . . . . 0.0 110.314 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.99 35.64 3.17 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.195 -0.94 . . . . 0.0 110.319 179.411 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.9 t -111.26 -55.58 2.48 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.151 -0.968 . . . . 0.0 109.294 179.277 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -20.84 65.53 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.229 -0.92 . . . . 0.0 111.118 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 47.0 mm -71.91 -49.09 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.668 -1.27 . . . . 0.0 109.546 179.769 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -41.37 80.57 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.123 -0.986 . . . . 0.0 109.939 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.4 mmtm -59.95 -34.98 73.98 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.159 -0.963 . . . . 0.0 110.478 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.8 m -91.38 -40.15 11.61 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.996 -1.065 . . . . 0.0 110.518 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 47.1 p -65.32 -39.37 92.35 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.069 -1.019 . . . . 0.0 110.068 179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.49 -38.38 71.66 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.101 -1.0 . . . . 0.0 110.366 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.55 48.65 1.09 Allowed 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.198 -0.938 . . . . 0.0 110.716 179.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.423 ' CE1' ' CB ' ' A' ' 25' ' ' CYS . 7.2 t80 -92.89 -37.37 12.3 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.151 -0.968 . . . . 0.0 110.373 179.681 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -111.86 65.84 0.63 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.125 -0.984 . . . . 0.0 110.181 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.89 46.73 1.6 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.247 -0.908 . . . . 0.0 110.107 179.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.34 -41.16 26.58 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.909 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mttp . . . . . 0 N--CA 1.496 1.831 0 O-C-N 121.132 -1.217 . . . . 0.0 110.19 179.969 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 ptp . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.64 146.48 43.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.396 1.208 . . . . 0.0 110.41 -179.911 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -132.8 153.12 51.56 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -112.16 162.55 15.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.161 -0.962 . . . . 0.0 110.466 -179.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -132.22 139.65 48.39 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.15 -0.969 . . . . 0.0 110.223 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -121.06 96.86 5.26 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.08 -1.013 . . . . 0.0 110.098 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -53.53 -36.4 61.74 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.061 -1.024 . . . . 0.0 110.407 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.425 ' CE1' HG12 ' A' ' 34' ' ' VAL . 84.8 m-85 -60.7 -32.02 71.27 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.095 -1.003 . . . . 0.0 110.125 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.9 m -96.82 -6.07 36.88 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.966 -1.084 . . . . 0.0 112.126 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 54.17 39.45 30.73 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.453 -1.405 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.4 t -144.71 169.92 17.08 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.267 -0.895 . . . . 0.0 110.021 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -115.84 130.94 57.04 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.205 -0.934 . . . . 0.0 110.425 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.88 169.3 14.25 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.183 -0.948 . . . . 0.0 109.756 179.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -100.81 -21.83 15.03 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.195 -0.941 . . . . 0.0 112.108 -179.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -126.26 143.44 51.15 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.616 -1.303 . . . . 0.0 110.315 -179.909 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -120.79 92.04 3.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -139.06 178.21 1.74 Allowed Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.227 -0.921 . . . . 0.0 109.985 -179.55 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -70.66 -29.43 19.58 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.394 1.207 . . . . 0.0 111.114 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.411 ' O ' ' OG1' ' A' ' 23' ' ' THR . 4.7 t -90.96 -41.61 11.03 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.899 -1.126 . . . . 0.0 110.033 179.612 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.7 t -60.11 -49.82 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.807 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -57.96 -51.67 68.68 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.066 -1.021 . . . . 0.0 109.661 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -61.81 -40.37 95.03 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.16 -0.962 . . . . 0.0 108.799 178.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.411 ' OG1' ' O ' ' A' ' 19' ' ' SER . 97.5 m -55.16 -43.1 73.95 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.142 -0.974 . . . . 0.0 108.382 178.237 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -63.07 -38.97 93.31 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.66 50.97 1.14 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.22 -0.925 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.7 m -117.79 37.73 3.85 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.096 -1.002 . . . . 0.0 110.313 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.77 126.95 2.77 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.2 ttt85 -54.4 -28.44 43.61 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.235 -1.156 . . . . 0.0 110.319 179.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -59.2 -34.76 72.54 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.96 -1.088 . . . . 0.0 110.35 179.861 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -51.14 -40.19 58.0 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.912 -1.117 . . . . 0.0 110.514 -179.664 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -63.33 -54.68 33.24 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.263 -0.975 . . . . 0.0 109.025 179.182 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.69 -39.52 88.81 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 178.68 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -57.01 -37.76 72.14 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.199 -0.938 . . . . 0.0 110.035 179.18 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.425 HG12 ' CE1' ' A' ' 8' ' ' TYR . 85.8 t -56.5 -34.04 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 O-C-N 121.093 -1.004 . . . . 0.0 110.253 179.75 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.8 tttp -52.85 -40.95 63.82 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.855 -1.153 . . . . 0.0 110.029 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -59.33 -29.6 67.76 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.261 178.868 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -68.05 -51.55 45.4 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.94 -1.1 . . . . 0.0 110.327 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.0 p90 -100.16 35.62 2.04 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.068 -1.02 . . . . 0.0 111.157 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -87.95 -37.91 16.01 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.863 -1.148 . . . . 0.0 110.001 178.694 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -110.79 29.63 7.57 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.273 -0.892 . . . . 0.0 110.865 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.418 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 26.5 t90 -93.98 -42.74 8.89 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.02 -1.05 . . . . 0.0 110.01 179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.418 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -145.59 -60.28 0.34 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.206 -0.934 . . . . 0.0 110.382 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -146.08 -171.17 3.66 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.128 -0.983 . . . . 0.0 110.266 -179.919 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -106.59 39.57 1.81 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.122 -0.986 . . . . 0.0 110.137 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -150.75 76.14 1.24 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.259 -0.9 . . . . 0.0 110.405 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -141.15 73.66 1.43 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.17 -0.956 . . . . 0.0 110.297 -179.902 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.22 35.49 4.63 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.597 179.673 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 5.5 p -110.58 -54.18 2.61 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.068 -1.02 . . . . 0.0 109.463 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -61.47 -20.9 63.66 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.183 -0.948 . . . . 0.0 111.377 179.28 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.404 ' O ' ' OG1' ' A' ' 54' ' ' THR . 47.3 mm -71.56 -42.64 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 120.719 -1.238 . . . . 0.0 109.509 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.432 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 23.7 t70 -65.22 -39.57 92.95 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.161 -0.962 . . . . 0.0 110.053 -179.998 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -64.36 -34.83 79.07 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.08 -1.013 . . . . 0.0 110.626 -179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m -90.73 -39.09 12.62 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 120.993 -1.067 . . . . 0.0 110.447 179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.432 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 17.6 p -57.13 -38.17 73.09 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.0 -1.063 . . . . 0.0 110.372 -179.931 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.65 -40.4 83.34 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.09 -1.006 . . . . 0.0 110.145 179.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.07 93.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.188 -0.945 . . . . 0.0 110.045 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.68 -36.57 62.31 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.055 -1.028 . . . . 0.0 110.641 -179.924 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -97.94 -42.62 7.44 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.089 -1.007 . . . . 0.0 110.271 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 53.76 88.17 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.893 -1.129 . . . . 0.0 110.775 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.26 64.47 0.26 Allowed Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.8 ttpp . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.175 -1.191 . . . . 0.0 110.258 -180.0 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ttp . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.73 148.36 46.6 Favored 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.427 1.225 . . . . 0.0 110.29 179.92 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt 61.98 132.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.223 -0.923 . . . . 0.0 110.539 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.402 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 39.3 t80 -112.26 151.9 29.1 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.041 -1.037 . . . . 0.0 110.19 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -125.93 137.18 53.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.19 -0.944 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 36.2 t -114.77 92.37 3.92 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.213 -0.929 . . . . 0.0 110.061 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -51.45 -35.94 41.87 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.093 -1.004 . . . . 0.0 110.361 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.434 ' CE2' HG12 ' A' ' 34' ' ' VAL . 90.9 m-85 -60.0 -31.08 69.59 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.138 -0.976 . . . . 0.0 110.008 178.882 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 m -98.9 0.84 44.96 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.002 -1.061 . . . . 0.0 112.237 179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.1 38.34 23.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.315 -1.491 . . . . 0.0 110.679 -179.662 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -146.61 171.68 14.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.401 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER -125.94 126.5 44.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.251 -179.73 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -77.32 167.43 21.72 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.173 -0.955 . . . . 0.0 109.885 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.1 t -100.15 -30.49 11.9 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.137 -0.977 . . . . 0.0 111.635 -179.702 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -110.4 144.63 38.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.772 -1.205 . . . . 0.0 110.32 -179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -121.87 95.31 4.61 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.418 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.77 177.93 1.67 Allowed Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.192 -0.943 . . . . 0.0 110.158 -179.578 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.418 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.2 Cg_endo -71.16 -32.41 13.09 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.396 1.209 . . . . 0.0 110.916 179.859 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.403 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.8 t -87.4 -40.02 14.75 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.974 -1.079 . . . . 0.0 110.0 179.588 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -61.11 -45.62 98.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.131 -0.981 . . . . 0.0 109.612 179.724 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 46.8 mtt180 -60.0 -53.79 53.71 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.096 -1.002 . . . . 0.0 109.483 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -59.79 -39.51 85.2 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.142 -0.974 . . . . 0.0 109.026 178.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 19' ' ' SER . 96.7 m -55.31 -42.79 74.19 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.075 -1.016 . . . . 0.0 108.517 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -63.12 -37.05 85.67 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.153 178.116 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 49.01 1.02 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.116 -0.99 . . . . 0.0 110.509 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 m -115.51 38.6 3.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.104 -0.997 . . . . 0.0 110.182 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.2 126.03 2.4 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.8 ttm-85 -53.31 -29.18 32.28 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.115 -1.226 . . . . 0.0 110.398 179.046 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 -33.92 70.14 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.042 -1.036 . . . . 0.0 110.654 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -51.34 -38.92 55.67 Favored 'General case' 0 N--CA 1.516 2.84 0 O-C-N 120.908 -1.12 . . . . 0.0 110.603 -179.591 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -62.99 -53.85 47.53 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.089 179.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.49 -39.26 87.05 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.22 -0.925 . . . . 0.0 108.956 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.52 -39.07 70.06 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.212 -0.93 . . . . 0.0 110.083 179.208 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.434 HG12 ' CE2' ' A' ' 8' ' ' TYR . 76.4 t -60.17 -36.44 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.071 -1.018 . . . . 0.0 109.761 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 61.2 tttp -52.75 -40.35 63.01 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.974 -1.078 . . . . 0.0 109.993 179.565 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.87 -33.44 68.7 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 179.12 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -63.94 -52.63 58.88 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.082 -1.011 . . . . 0.0 109.961 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 48.8 p90 -100.34 33.72 2.59 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.142 -0.973 . . . . 0.0 111.109 179.631 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -81.39 -38.81 25.96 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.781 -1.199 . . . . 0.0 110.181 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -117.08 21.21 13.37 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.244 -0.91 . . . . 0.0 111.636 179.791 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 17.6 t90 -59.85 -40.0 87.09 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.827 -1.171 . . . . 0.0 110.038 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.464 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 4.6 mtm -149.9 37.99 0.73 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -0.968 . . . . 0.0 110.59 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.16 38.18 20.32 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.0 -1.063 . . . . 0.0 110.975 179.924 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -145.99 -172.98 4.04 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.252 -0.905 . . . . 0.0 110.418 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -113.58 125.12 53.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 110.121 179.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -124.29 76.17 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.208 -0.932 . . . . 0.0 110.311 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -106.74 36.15 2.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.178 -0.951 . . . . 0.0 110.379 179.479 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -113.12 -54.9 2.58 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.214 -0.928 . . . . 0.0 109.571 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -22.01 61.55 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.186 -0.946 . . . . 0.0 111.463 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.426 HG21 HD11 ' A' ' 50' ' ' ILE . 45.9 mm -68.34 -47.13 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 120.606 -1.309 . . . . 0.0 109.371 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -57.54 -36.7 71.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.155 -0.966 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -77.18 -34.81 56.24 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.016 -1.053 . . . . 0.0 110.643 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.4 m -82.53 -38.62 23.52 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.034 -1.041 . . . . 0.0 110.26 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 7.9 p -56.97 -37.52 71.71 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.09 -1.006 . . . . 0.0 110.452 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.95 -39.6 29.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.096 -1.003 . . . . 0.0 109.923 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.03 64.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.052 -1.03 . . . . 0.0 110.578 179.829 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -91.24 -40.24 11.64 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.098 -1.001 . . . . 0.0 110.208 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -59.53 -57.25 13.79 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.159 -0.963 . . . . 0.0 110.066 -179.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -140.84 -59.63 0.51 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.23 -0.918 . . . . 0.0 110.276 -179.896 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.17 42.18 4.39 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.204 -1.174 . . . . 0.0 110.216 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ptt? . . . . . 0 N--CA 1.5 2.033 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.97 79.76 1.61 Allowed 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.272 1.143 . . . . 0.0 110.285 179.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 mttp -136.4 151.07 49.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.296 -0.877 . . . . 0.0 110.113 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.4 t80 -109.62 161.86 14.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.219 -0.926 . . . . 0.0 110.118 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -136.51 135.33 38.44 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.141 -0.974 . . . . 0.0 110.24 -179.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -116.84 92.72 3.94 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.146 -0.971 . . . . 0.0 110.001 179.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -51.78 -35.77 45.05 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.014 -1.054 . . . . 0.0 110.408 179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE1' HG12 ' A' ' 34' ' ' VAL . 92.5 m-85 -60.04 -32.95 71.39 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.133 -0.979 . . . . 0.0 110.004 179.008 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 m -95.54 -2.83 47.71 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.051 -1.031 . . . . 0.0 112.254 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.23 39.71 30.12 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.324 -1.485 . . . . 0.0 110.399 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -145.66 171.4 14.77 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.359 -0.838 . . . . 0.0 110.191 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -118.41 140.37 49.96 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.246 -0.909 . . . . 0.0 110.565 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.3 mp -96.72 167.19 11.27 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.204 -0.935 . . . . 0.0 109.623 179.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.416 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -100.05 -29.81 12.32 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.847 -179.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.416 ' CD2' HG21 ' A' ' 14' ' ' THR . 51.3 m-70 -113.0 147.58 36.87 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.742 -1.223 . . . . 0.0 110.379 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -126.55 93.93 3.92 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.238 -0.914 . . . . 0.0 109.789 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.61 177.83 1.64 Allowed Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.194 -0.941 . . . . 0.0 110.277 -179.598 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -69.95 -27.66 25.31 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.383 1.202 . . . . 0.0 111.154 179.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.75 -39.0 12.04 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.92 -1.113 . . . . 0.0 110.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.93 -49.26 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.001 -1.062 . . . . 0.0 109.562 179.809 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -57.55 -48.43 79.33 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.141 -0.975 . . . . 0.0 109.635 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.0 -41.26 97.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.196 -0.94 . . . . 0.0 108.725 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.4 m -54.21 -43.22 70.61 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.18 -0.95 . . . . 0.0 108.439 178.336 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -63.19 -39.39 94.52 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 119.636 -0.826 . . . . 0.0 108.871 177.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -95.3 53.61 1.53 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.223 -0.923 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.55 37.83 3.79 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.094 -1.004 . . . . 0.0 110.33 179.859 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.79 126.62 2.31 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -28.54 46.48 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.129 -1.218 . . . . 0.0 110.102 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -57.14 -33.05 67.0 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.002 -1.061 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -49.36 -37.87 26.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.99 -1.069 . . . . 0.0 110.915 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -59.65 -56.38 22.58 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.096 -1.002 . . . . 0.0 109.479 179.465 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.25 -38.89 81.15 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.227 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.54 -36.69 69.53 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.106 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE1' ' A' ' 8' ' ' TYR . 50.3 t -55.65 -35.46 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.056 -1.028 . . . . 0.0 110.31 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.5 mtpt -52.93 -40.38 63.56 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.879 -1.138 . . . . 0.0 110.115 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.97 -29.95 63.67 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 179.11 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.61 -53.31 23.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.907 -1.121 . . . . 0.0 110.094 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 41.1 p90 -100.2 36.01 1.96 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.117 -0.99 . . . . 0.0 111.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.71 -36.76 23.46 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.705 -1.247 . . . . 0.0 110.359 179.144 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mttp -104.8 23.63 13.15 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.217 -0.927 . . . . 0.0 111.229 179.564 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.474 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.3 t90 -105.19 -49.87 3.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.886 -1.134 . . . . 0.0 110.414 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.474 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -104.94 -47.97 3.87 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.142 -0.974 . . . . 0.0 110.38 179.939 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 54.62 38.62 30.25 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.917 -1.114 . . . . 0.0 110.628 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -151.77 -65.94 0.18 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.21 -0.931 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.35 82.41 0.41 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.165 -0.959 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.64 73.04 1.5 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.372 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -121.12 33.67 5.47 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.157 -0.964 . . . . 0.0 110.609 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -50.44 3.04 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.027 -1.046 . . . . 0.0 109.825 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -21.08 63.5 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.179 -0.95 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.422 HD13 ' CE1' ' A' ' 38' ' ' TYR . 48.6 mm -74.36 -38.73 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 O-C-N 120.673 -1.267 . . . . 0.0 109.944 179.742 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -83.55 -39.21 20.69 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.121 -0.987 . . . . 0.0 110.079 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -37.89 89.06 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.132 -0.98 . . . . 0.0 110.007 179.596 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.0 m -77.21 -35.89 55.26 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.079 -1.013 . . . . 0.0 110.287 179.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.0 p -81.3 -40.0 24.33 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.053 -1.029 . . . . 0.0 110.066 179.787 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.26 -39.2 82.14 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.168 -0.957 . . . . 0.0 110.118 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.17 -39.2 72.01 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.169 -0.957 . . . . 0.0 110.413 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.91 -67.6 0.42 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.179 -0.951 . . . . 0.0 109.841 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 51.48 53.75 12.26 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.044 -1.035 . . . . 0.0 110.85 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -128.06 73.69 1.49 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.181 -0.949 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.1 -108.99 2.92 Favored Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 mttp . . . . . 0 N--CA 1.494 1.731 0 O-C-N 121.303 -1.116 . . . . 0.0 110.174 -179.975 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 mtp . . . . . 0 N--CA 1.505 2.307 0 CA-C-O 119.896 -0.097 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -73.94 99.37 1.16 Allowed 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.131 1.069 . . . . 0.0 110.52 -179.861 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 53.8 mttp -131.88 153.77 49.88 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.24 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.418 ' CE1' ' HD3' ' A' ' 21' ' ' ARG . 67.5 t80 -110.14 161.73 15.28 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.226 -0.921 . . . . 0.0 110.06 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -125.44 133.91 52.29 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.25 99.75 7.84 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.068 -1.02 . . . . 0.0 110.003 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -52.74 -36.02 56.99 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 120.977 -1.077 . . . . 0.0 110.548 179.942 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.417 ' CE1' HG12 ' A' ' 34' ' ' VAL . 94.9 m-85 -62.8 -30.43 71.46 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.097 -1.002 . . . . 0.0 110.267 179.243 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 50.0 m -99.84 -12.04 20.23 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.981 -1.074 . . . . 0.0 111.979 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.5 t70 57.14 41.88 26.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.405 -1.434 . . . . 0.0 109.972 -179.42 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -143.73 174.23 10.98 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 5.7 t80 -115.8 112.72 22.4 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.274 -0.892 . . . . 0.0 110.46 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.416 HD23 ' CG ' ' A' ' 24' ' ' HIS . 3.6 mp -65.91 171.27 4.57 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.233 -0.917 . . . . 0.0 109.713 179.688 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.416 HG21 ' CD2' ' A' ' 15' ' ' HIS . 13.5 t -97.34 -30.1 13.14 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.235 -0.916 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.416 ' CD2' HG21 ' A' ' 14' ' ' THR . 44.8 m-70 -115.45 148.87 38.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.952 -1.092 . . . . 0.0 110.34 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -126.45 93.97 3.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 109.692 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -147.24 178.87 1.3 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.201 -0.937 . . . . 0.0 110.082 -179.641 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.58 -31.18 13.89 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.326 1.172 . . . . 0.0 110.971 179.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 t -88.13 -38.78 15.08 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.958 -1.089 . . . . 0.0 110.029 179.443 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.89 -45.84 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 121.081 -1.012 . . . . 0.0 109.416 179.568 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.418 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 24.5 mtt180 -59.35 -52.24 66.48 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.464 179.768 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -41.02 97.9 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.858 178.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -56.19 -43.22 78.25 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.098 -1.001 . . . . 0.0 108.564 178.249 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.416 ' CG ' HD23 ' A' ' 13' ' ' LEU . 64.8 t60 -61.71 -34.56 76.01 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.27 178.086 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -100.47 40.35 1.27 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.071 -1.018 . . . . 0.0 110.633 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 28.8 m -116.27 38.5 3.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.171 -0.956 . . . . 0.0 110.003 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.65 129.93 4.53 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -54.57 -28.56 46.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.189 -1.183 . . . . 0.0 110.403 179.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -60.07 -36.85 78.27 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.964 -1.085 . . . . 0.0 110.475 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -51.38 -36.37 43.02 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 120.942 -1.099 . . . . 0.0 110.632 -179.704 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -55.57 -52.03 65.1 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.0 -1.063 . . . . 0.0 109.768 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -61.11 -40.53 94.09 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.405 -0.918 . . . . 0.0 108.996 178.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -56.56 -37.07 70.03 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.252 -0.905 . . . . 0.0 110.3 179.171 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.417 HG12 ' CE1' ' A' ' 8' ' ' TYR . 97.6 t -64.94 -37.02 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.083 -1.011 . . . . 0.0 110.048 179.8 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.1 tppt? -53.71 -42.43 68.04 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 120.83 -1.169 . . . . 0.0 109.925 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.66 -28.04 65.34 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.424 179.067 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -72.86 -51.54 18.33 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.893 -1.129 . . . . 0.0 110.528 -179.752 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.2 p90 -99.63 35.4 2.0 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.03 -1.044 . . . . 0.0 111.415 179.97 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.68 -39.11 15.27 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.828 -1.17 . . . . 0.0 109.98 178.85 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -116.72 34.22 5.18 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.252 -0.905 . . . . 0.0 110.599 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.4 t90 -91.51 -39.03 12.16 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.175 -0.953 . . . . 0.0 110.282 -179.853 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 mtm -154.32 -67.24 0.14 Allowed 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.121 -0.987 . . . . 0.0 110.579 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -135.05 -171.82 2.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.192 -0.943 . . . . 0.0 110.126 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -110.12 39.42 2.16 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.0 110.154 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -146.7 74.33 1.35 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.162 -0.961 . . . . 0.0 110.266 179.876 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.41 73.35 1.37 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.95 35.06 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.113 -0.992 . . . . 0.0 110.502 179.58 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 59.9 p -109.71 -53.48 2.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.149 -0.969 . . . . 0.0 109.473 179.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -20.96 63.48 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.216 -0.928 . . . . 0.0 111.339 179.205 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.441 HD11 HG22 ' A' ' 50' ' ' ILE . 49.0 mm -74.33 -47.21 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.66 -1.275 . . . . 0.0 109.701 179.628 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.421 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 8.2 t0 -58.27 -40.03 80.81 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.214 -0.928 . . . . 0.0 110.068 179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.1 mttm -57.41 -35.91 70.65 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.577 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.4 m -90.89 -39.04 12.52 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.965 -1.084 . . . . 0.0 110.394 179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.421 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 72.3 p -70.98 -35.51 72.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.1 -1.0 . . . . 0.0 110.33 179.641 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.58 -42.37 10.83 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.112 -0.993 . . . . 0.0 110.151 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.3 56.51 2.18 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.162 -0.961 . . . . 0.0 110.303 179.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -92.6 -56.62 2.95 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.191 -0.943 . . . . 0.0 110.064 179.716 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -144.75 72.63 1.34 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? 52.89 73.46 0.35 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.08 -1.013 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.29 -107.55 3.11 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 O-C-N 121.178 -1.189 . . . . 0.0 110.247 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.82 171.16 17.95 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 O-C-N 123.284 1.149 . . . . 0.0 110.501 -179.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.1 mttt -113.16 155.31 25.21 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.297 -0.877 . . . . 0.0 110.201 -179.951 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -115.23 159.47 20.93 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.191 -0.943 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -136.61 139.48 42.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.099 -1.001 . . . . 0.0 110.7 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.1 t -112.23 96.98 6.33 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.896 . . . . 0.0 110.105 179.519 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -54.8 -36.43 64.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.056 -1.028 . . . . 0.0 110.339 179.865 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE1' HG12 ' A' ' 34' ' ' VAL . 90.0 m-85 -60.44 -32.08 71.02 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.117 -0.989 . . . . 0.0 110.049 179.23 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.7 m -96.91 -2.74 43.16 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.957 -1.089 . . . . 0.0 112.14 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 53.77 38.69 29.08 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.397 -1.44 . . . . 0.0 110.475 -179.545 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -140.1 174.85 10.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -0.912 . . . . 0.0 109.899 179.894 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.79 121.77 38.9 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.268 -0.895 . . . . 0.0 110.258 -179.633 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -80.52 166.51 21.11 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.043 -1.036 . . . . 0.0 109.544 179.371 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.42 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -100.89 -29.5 12.19 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.125 -0.984 . . . . 0.0 111.891 -179.535 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.42 ' CD2' HG21 ' A' ' 14' ' ' THR . 53.0 m-70 -112.23 146.79 37.52 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.824 -1.173 . . . . 0.0 110.276 -179.821 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -125.13 93.51 3.9 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 109.849 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.21 178.68 1.36 Allowed Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.39 -31.27 14.26 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.267 1.14 . . . . 0.0 110.87 179.888 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.4 ' O ' ' OG1' ' A' ' 23' ' ' THR . 2.8 t -87.16 -40.15 14.86 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.937 -1.102 . . . . 0.0 109.979 179.591 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.3 t -61.57 -49.03 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 121.183 -0.948 . . . . 0.0 109.476 179.655 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.6 mtp-105 -58.39 -50.76 72.51 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.53 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -62.08 -41.16 97.9 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.111 -0.993 . . . . 0.0 108.803 178.803 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.4 m -55.67 -43.38 76.3 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.13 -0.981 . . . . 0.0 108.451 178.376 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -62.33 -38.76 90.72 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.404 -0.81 . . . . 0.0 108.922 178.02 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -92.7 55.86 2.53 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.227 -0.921 . . . . 0.0 110.31 -179.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.98 37.4 4.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.055 -1.028 . . . . 0.0 110.326 179.789 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.28 128.64 3.46 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.0 ttp-105 -54.64 -28.12 44.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.171 -1.193 . . . . 0.0 110.639 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -62.47 -34.1 76.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.929 -1.107 . . . . 0.0 110.574 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -51.58 -41.78 61.43 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.946 -1.096 . . . . 0.0 110.583 -179.595 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -62.54 -54.65 36.7 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.091 179.31 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -39.15 83.9 Favored 'General case' 0 N--CA 1.508 2.471 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.117 178.572 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -55.94 -38.18 69.97 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.227 -0.92 . . . . 0.0 110.069 179.172 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE1' ' A' ' 8' ' ' TYR . 95.2 t -65.95 -34.51 70.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.148 -0.97 . . . . 0.0 110.025 179.61 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 25.4 tttt -52.14 -39.92 60.64 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.909 -1.119 . . . . 0.0 109.983 179.431 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -59.07 -29.49 67.37 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 178.903 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -71.72 -53.09 14.6 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.862 -1.149 . . . . 0.0 110.278 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 37.0 p90 -99.27 32.0 2.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.068 -1.02 . . . . 0.0 111.448 179.852 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.47 -38.94 54.59 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.728 -1.232 . . . . 0.0 110.138 179.166 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.11 31.28 5.83 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.212 -0.93 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.8 t90 -108.51 -57.42 2.13 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.073 -1.017 . . . . 0.0 110.404 -179.758 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.45 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 0.5 OUTLIER -123.11 54.05 1.27 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.232 -0.918 . . . . 0.0 110.015 -179.989 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 -171.36 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.022 -1.049 . . . . 0.0 110.581 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -82.29 -172.86 4.23 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.163 -0.961 . . . . 0.0 110.0 179.987 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 54.76 73.89 0.38 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.015 -1.053 . . . . 0.0 110.493 -179.801 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.403 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -148.97 69.99 1.09 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.202 -0.936 . . . . 0.0 110.413 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -114.0 33.94 4.94 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.274 -0.891 . . . . 0.0 110.589 179.62 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -105.9 -51.6 2.96 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.053 -1.03 . . . . 0.0 109.309 179.198 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.4 -21.65 62.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.239 -0.913 . . . . 0.0 111.355 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.406 ' O ' ' OG1' ' A' ' 54' ' ' THR . 50.1 mm -79.27 -46.31 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.595 -1.316 . . . . 0.0 109.741 179.633 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.72 -37.62 82.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -75.74 -35.53 60.18 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.148 -0.97 . . . . 0.0 110.584 179.946 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.9 m -82.81 -39.92 21.08 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.08 -1.012 . . . . 0.0 110.071 179.852 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 33.6 p -58.95 -39.08 80.56 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.126 -0.984 . . . . 0.0 110.206 179.874 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.36 -42.37 9.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.166 -0.959 . . . . 0.0 110.003 179.674 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.88 55.47 1.86 Allowed 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.091 -1.006 . . . . 0.0 110.293 179.601 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -92.95 -50.6 5.46 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.213 -0.93 . . . . 0.0 110.217 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -119.03 48.19 1.53 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.215 -0.928 . . . . 0.0 110.32 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 52.53 79.64 0.11 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.034 -1.041 . . . . 0.0 110.801 179.95 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -107.97 -54.57 0.63 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.4 tttp . . . . . 0 N--CA 1.494 1.759 0 O-C-N 121.25 -1.147 . . . . 0.0 110.17 179.949 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mtt . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.43 160.27 44.93 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.377 1.199 . . . . 0.0 110.358 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.422 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 26.3 mttt 55.07 100.3 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.186 -0.946 . . . . 0.0 110.67 -179.995 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -54.65 156.73 3.35 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.089 -1.007 . . . . 0.0 110.937 -179.553 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -137.75 129.75 28.82 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.36 -0.838 . . . . 0.0 109.145 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.2 t -109.99 92.69 4.15 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.024 -1.047 . . . . 0.0 110.523 179.89 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.13 -35.35 59.59 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.059 -1.026 . . . . 0.0 110.201 179.327 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.442 ' CE1' HG12 ' A' ' 34' ' ' VAL . 84.0 m-85 -60.44 -34.43 73.97 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.109 -0.995 . . . . 0.0 109.941 179.14 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.8 m -96.27 -0.29 49.9 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.089 -1.007 . . . . 0.0 112.136 -179.922 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.55 38.57 26.07 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.365 -1.459 . . . . 0.0 110.678 -179.755 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -139.56 166.97 23.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.979 . . . . 0.0 110.042 179.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 22.4 t80 -120.35 127.11 52.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.211 -0.931 . . . . 0.0 110.22 -179.712 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.86 167.58 15.87 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.527 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.415 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -99.47 -31.62 11.55 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.114 -0.991 . . . . 0.0 111.708 -179.34 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.415 ' CD2' HG21 ' A' ' 14' ' ' THR . 36.9 m-70 -117.72 139.43 51.05 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.899 -1.126 . . . . 0.0 110.278 -179.872 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -114.66 94.18 4.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.215 -0.928 . . . . 0.0 109.821 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -139.21 178.72 1.52 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.292 -0.88 . . . . 0.0 110.072 -179.653 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.76 -32.2 14.81 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.351 1.185 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.42 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.4 OUTLIER -86.72 -44.4 11.83 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.966 -1.084 . . . . 0.0 109.737 179.44 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.2 t -60.43 -51.35 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 121.17 -0.956 . . . . 0.0 109.552 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -58.49 -50.47 73.62 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.084 -1.01 . . . . 0.0 109.393 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -61.32 -40.12 93.05 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.874 178.77 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 19' ' ' SER . 68.9 m -54.07 -42.87 69.78 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.105 -0.997 . . . . 0.0 108.562 178.262 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -63.06 -39.85 95.93 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.361 -0.837 . . . . 0.0 108.898 178.135 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.81 56.64 2.35 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.32 -0.862 . . . . 0.0 110.089 -179.912 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.95 37.74 3.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.154 -0.966 . . . . 0.0 110.362 179.892 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -149.51 124.59 1.82 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.991 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -28.31 39.13 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.075 -1.25 . . . . 0.0 110.4 178.946 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -60.07 -31.34 69.92 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.948 -1.095 . . . . 0.0 110.691 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -49.04 -38.1 22.87 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.91 -1.119 . . . . 0.0 110.986 -179.499 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.21 -54.66 29.96 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.014 179.284 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -60.91 -39.28 88.75 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.034 178.703 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -55.94 -37.04 68.44 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.191 -0.943 . . . . 0.0 110.075 179.15 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.442 HG12 ' CE1' ' A' ' 8' ' ' TYR . 50.1 t -55.22 -36.44 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.635 0 O-C-N 121.033 -1.042 . . . . 0.0 110.035 179.769 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.4 tttt -57.6 -42.24 82.84 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 120.969 -1.082 . . . . 0.0 109.481 179.309 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -59.18 -26.86 65.17 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.305 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -70.12 -52.52 23.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.893 -1.129 . . . . 0.0 110.406 -179.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 32.8 p90 -97.45 20.94 10.85 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.036 -1.04 . . . . 0.0 111.947 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -61.48 -40.0 92.97 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.6 -1.312 . . . . 0.0 109.848 179.192 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.22 31.38 6.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.23 -0.919 . . . . 0.0 110.875 179.723 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.417 ' CE2' ' HE3' ' A' ' 42' ' ' MET . 24.2 t90 -77.29 -59.17 2.89 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.133 -0.979 . . . . 0.0 110.316 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.417 ' HE3' ' CE2' ' A' ' 41' ' ' TRP . 7.1 tpp -137.52 -59.55 0.67 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.121 -0.987 . . . . 0.0 110.539 -179.788 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -114.86 -173.54 2.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.162 -0.961 . . . . 0.0 110.411 -179.797 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -97.49 -35.78 10.54 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.27 -0.894 . . . . 0.0 110.849 -179.946 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -106.13 83.79 1.95 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.93 -1.106 . . . . 0.0 110.399 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.408 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -115.47 70.41 0.75 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.247 -0.908 . . . . 0.0 109.873 179.715 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.66 34.86 4.53 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.199 -0.938 . . . . 0.0 110.54 179.847 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 t -107.49 -53.78 2.57 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.087 -1.008 . . . . 0.0 109.213 179.118 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.17 -20.7 64.41 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.307 -0.87 . . . . 0.0 111.31 179.109 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.4 mm -77.58 -40.64 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 120.731 -1.231 . . . . 0.0 109.894 179.797 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -58.53 -38.65 78.22 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.175 -0.953 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -73.46 -37.35 65.83 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.157 -0.964 . . . . 0.0 110.202 179.772 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.3 m -76.29 -35.96 58.62 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.045 -1.035 . . . . 0.0 110.366 179.742 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.1 p -76.63 -42.88 40.57 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.001 -1.062 . . . . 0.0 109.983 179.873 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.7 96.37 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.179 -0.951 . . . . 0.0 109.871 -179.981 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -98.38 32.88 2.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 111.348 179.672 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.88 -45.27 8.05 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.895 -1.128 . . . . 0.0 110.236 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -123.6 54.29 1.3 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.159 -0.963 . . . . 0.0 110.386 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -127.45 -58.61 1.25 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.115 -0.991 . . . . 0.0 110.293 179.886 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.18 95.14 1.48 Allowed Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt . . . . . 0 N--CA 1.494 1.753 0 O-C-N 121.244 -1.151 . . . . 0.0 110.17 179.93 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.77 116.51 4.73 Favored 'Trans proline' 0 C--N 1.317 -1.08 0 O-C-N 123.369 1.194 . . . . 0.0 110.535 179.999 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 mtmm -145.55 139.02 26.44 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.193 -0.942 . . . . 0.0 110.248 -179.917 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.411 ' CE1' ' HD3' ' A' ' 21' ' ' ARG . 64.6 t80 -111.28 157.86 19.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.158 -0.964 . . . . 0.0 110.141 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -125.95 135.72 52.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.164 -0.96 . . . . 0.0 110.62 -179.755 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.3 t -113.34 95.0 5.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.188 -0.945 . . . . 0.0 110.019 179.495 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -53.03 -36.08 60.15 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.062 -1.024 . . . . 0.0 110.478 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.421 ' CE2' HG12 ' A' ' 34' ' ' VAL . 83.0 m-85 -60.19 -32.96 71.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.088 -1.007 . . . . 0.0 109.927 179.108 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 25.1 m -95.47 -0.08 52.7 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.011 -1.056 . . . . 0.0 112.061 179.927 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.95 38.57 24.06 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.435 -1.416 . . . . 0.0 110.635 -179.783 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -148.9 171.15 16.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.291 -0.881 . . . . 0.0 110.149 179.933 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 4' ' ' PHE . 0.3 OUTLIER -117.36 124.94 50.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.198 -0.939 . . . . 0.0 110.238 -179.664 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -74.2 170.16 16.11 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.132 -0.98 . . . . 0.0 109.784 179.646 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -101.02 -21.36 15.05 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.236 -0.915 . . . . 0.0 112.176 -179.712 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -119.4 147.28 44.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.53 -1.356 . . . . 0.0 110.291 179.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -124.47 94.84 4.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.22 -0.925 . . . . 0.0 109.961 179.813 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.67 177.4 1.79 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.187 -0.946 . . . . 0.0 110.413 -179.625 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.86 -32.71 13.58 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.41 1.216 . . . . 0.0 110.845 179.849 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.405 ' O ' ' OG1' ' A' ' 23' ' ' THR . 5.4 m -87.26 -38.95 15.84 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.043 -1.036 . . . . 0.0 110.027 179.552 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.0 t -60.38 -49.31 84.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 179.645 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 19.9 mtt180 -58.26 -50.81 72.29 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.079 -1.013 . . . . 0.0 109.605 179.648 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.57 -41.33 98.87 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.346 -0.941 . . . . 0.0 108.748 178.825 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.5 m -55.96 -43.29 77.36 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.221 -0.924 . . . . 0.0 108.625 178.416 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -61.79 -36.25 80.55 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.701 -0.8 . . . . 0.0 109.199 178.218 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.14 52.31 1.28 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.135 -0.978 . . . . 0.0 110.274 -179.813 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -116.49 37.98 3.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.244 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.12 127.1 2.77 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 -179.981 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.7 ttt-85 -54.93 -28.05 47.98 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.097 -1.237 . . . . 0.0 110.342 179.179 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -60.05 -34.45 73.42 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.957 -1.09 . . . . 0.0 110.507 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -51.09 -39.1 55.31 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.948 -1.095 . . . . 0.0 110.537 -179.484 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -63.19 -55.37 25.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.101 -1.0 . . . . 0.0 109.084 179.328 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.95 -39.23 84.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.23 -0.919 . . . . 0.0 109.199 178.701 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -56.94 -38.18 72.56 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.217 -0.927 . . . . 0.0 110.036 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG12 ' CE2' ' A' ' 8' ' ' TYR . 90.0 t -58.19 -35.21 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.154 -0.966 . . . . 0.0 110.067 179.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.9 ttmt -52.27 -40.52 61.87 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.969 -1.082 . . . . 0.0 109.952 179.535 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -58.13 -29.95 65.95 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.577 -0.849 . . . . 0.0 110.298 178.96 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -69.2 -52.8 24.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.877 -1.14 . . . . 0.0 110.042 179.909 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.7 p90 -100.35 35.83 2.02 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.138 -0.976 . . . . 0.0 111.083 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -38.08 16.32 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.799 -1.188 . . . . 0.0 110.044 178.921 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -107.47 26.75 9.85 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.1 t90 -106.74 -55.99 2.25 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.966 -1.084 . . . . 0.0 109.893 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 1.3 mtm -128.64 55.43 1.7 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.252 -0.905 . . . . 0.0 109.713 179.711 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 55.8 -163.48 0.15 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.933 -1.104 . . . . 0.0 110.337 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -99.74 48.94 0.93 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.13 -0.981 . . . . 0.0 110.221 179.92 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -140.11 73.06 1.41 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.212 -0.93 . . . . 0.0 109.959 179.736 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.79 73.4 0.62 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.272 -0.892 . . . . 0.0 110.793 -179.823 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -112.51 35.3 3.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.16 -0.962 . . . . 0.0 110.434 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -109.06 -52.72 2.73 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.112 -0.992 . . . . 0.0 109.586 179.289 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.47 -20.93 63.7 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.232 -0.918 . . . . 0.0 111.464 179.335 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 48.7 mm -74.67 -45.95 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 120.747 -1.221 . . . . 0.0 109.835 179.842 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.425 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 43.5 m-20 -65.4 -40.7 93.76 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.229 -0.919 . . . . 0.0 110.067 -179.938 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -58.32 -36.75 73.85 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.147 -0.971 . . . . 0.0 110.532 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -91.4 -39.16 12.15 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.018 -1.052 . . . . 0.0 110.422 179.91 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 68.8 p -69.03 -37.51 78.65 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.063 -1.023 . . . . 0.0 110.299 179.941 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.93 -43.26 36.09 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.052 -1.03 . . . . 0.0 109.979 179.9 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -34.79 64.41 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.012 -1.055 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -91.51 -31.74 15.84 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.01 -1.057 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -97.46 -54.58 3.09 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.882 -1.136 . . . . 0.0 110.491 -179.862 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -114.87 48.57 1.13 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.152 -0.968 . . . . 0.0 110.297 -179.898 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -124.94 -110.56 1.83 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.973 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.214 -1.168 . . . . 0.0 110.165 179.991 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.21 149.9 46.61 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.488 1.257 . . . . 0.0 110.55 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt -129.18 168.4 16.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.223 -0.923 . . . . 0.0 109.985 179.891 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -111.46 160.87 16.71 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.19 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -143.68 131.15 21.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.161 -0.962 . . . . 0.0 110.375 -179.48 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.0 t -109.93 87.1 2.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.154 -0.967 . . . . 0.0 109.684 179.13 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -50.37 -35.71 29.24 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.11 -0.994 . . . . 0.0 110.937 -179.562 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.447 ' CZ ' ' CD1' ' A' ' 50' ' ' ILE . 25.5 m-85 -61.82 -30.64 70.96 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.084 -1.01 . . . . 0.0 109.919 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.1 m -98.48 0.52 45.3 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.943 -1.098 . . . . 0.0 112.058 179.674 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 52.89 38.08 25.96 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.395 -1.44 . . . . 0.0 110.839 -179.881 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -139.4 168.93 18.71 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.191 -0.943 . . . . 0.0 109.999 179.571 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -121.83 140.27 52.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.175 -0.953 . . . . 0.0 110.886 -179.69 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -106.44 152.63 23.38 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.247 -0.908 . . . . 0.0 109.39 179.302 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 t -99.1 -30.71 12.15 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.113 -0.992 . . . . 0.0 111.693 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -111.46 125.3 53.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.823 -1.173 . . . . 0.0 110.189 179.989 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -110.2 88.53 2.78 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.114 -0.991 . . . . 0.0 109.742 179.679 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -133.24 -179.78 1.17 Allowed Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 109.81 -179.602 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -71.05 -26.97 20.97 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.271 1.142 . . . . 0.0 111.238 179.885 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.418 ' O ' ' OG1' ' A' ' 23' ' ' THR . 68.0 m -90.17 -40.22 12.35 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.742 -1.224 . . . . 0.0 110.053 179.482 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.6 t -69.04 -48.35 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.06 -1.025 . . . . 0.0 109.699 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -59.06 -51.42 70.1 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.079 -1.013 . . . . 0.0 109.467 179.77 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -59.32 -40.2 85.5 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.163 -0.961 . . . . 0.0 108.891 178.862 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.418 ' OG1' ' O ' ' A' ' 19' ' ' SER . 49.7 m -54.67 -43.02 72.06 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.07 -1.019 . . . . 0.0 108.303 178.301 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -66.09 -40.93 91.19 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.739 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.66 57.15 2.49 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.322 -0.861 . . . . 0.0 110.093 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -113.34 37.97 3.03 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.047 -1.033 . . . . 0.0 110.453 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.12 124.49 1.61 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -53.76 -28.72 36.31 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.157 -1.202 . . . . 0.0 110.27 179.068 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -59.33 -31.24 68.99 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 110.701 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.2 t-80 -48.85 -48.05 42.25 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.927 -1.108 . . . . 0.0 111.175 -179.382 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -58.86 -53.33 59.57 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.053 -1.029 . . . . 0.0 109.37 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.44 -38.98 85.86 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.163 -0.961 . . . . 0.0 109.036 178.556 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -56.46 -38.98 72.4 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.24 -0.912 . . . . 0.0 110.027 179.249 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.426 HG12 ' CD2' ' A' ' 8' ' ' TYR . 97.3 t -60.17 -38.03 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.092 -1.005 . . . . 0.0 109.76 179.747 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 27.3 ttmt -53.65 -39.73 65.28 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.961 -1.087 . . . . 0.0 109.97 179.441 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -58.63 -34.74 71.51 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.209 -0.932 . . . . 0.0 109.997 179.162 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -64.27 -52.47 58.49 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.036 -1.04 . . . . 0.0 109.931 179.867 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.438 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.6 35.43 2.15 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.118 -0.989 . . . . 0.0 110.991 179.491 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -84.61 -37.71 20.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.8 -1.187 . . . . 0.0 110.267 179.138 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -111.5 21.82 15.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.132 -0.98 . . . . 0.0 111.482 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.7 t90 -60.44 -46.91 88.35 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.861 -1.149 . . . . 0.0 109.963 179.949 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.5 mtm -151.68 36.74 0.57 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.155 -0.965 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 50.9 41.63 27.13 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.011 -1.055 . . . . 0.0 110.899 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.4 -168.03 2.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.162 -0.961 . . . . 0.0 110.318 -179.931 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -117.96 124.86 49.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.406 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -125.78 76.7 1.6 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.241 -0.912 . . . . 0.0 110.259 -179.898 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.81 35.71 3.26 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.201 -0.937 . . . . 0.0 110.57 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.3 t -112.77 -55.66 2.5 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.209 -0.932 . . . . 0.0 109.378 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -21.28 64.25 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.225 -0.922 . . . . 0.0 111.064 179.075 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.447 ' CD1' ' CZ ' ' A' ' 8' ' ' TYR . 47.5 mm -69.92 -41.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.608 -1.307 . . . . 0.0 109.306 179.498 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -71.46 -37.04 71.4 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.19 -0.944 . . . . 0.0 110.327 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -80.3 -36.31 34.53 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.106 -0.996 . . . . 0.0 110.367 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.2 m -73.32 -37.4 66.17 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.08 -1.013 . . . . 0.0 110.339 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.0 p -65.56 -40.02 92.35 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.047 -1.033 . . . . 0.0 110.289 -179.887 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.29 -40.55 10.88 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.187 -0.945 . . . . 0.0 110.194 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.36 53.46 1.5 Allowed 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.167 -0.958 . . . . 0.0 110.548 179.756 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.48 -41.45 10.27 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.141 -0.974 . . . . 0.0 109.852 179.521 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -131.47 39.9 3.46 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.288 -0.882 . . . . 0.0 110.2 179.887 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 52.49 41.03 30.78 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.997 -1.064 . . . . 0.0 110.823 -179.955 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.41 -109.59 3.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.982 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 tttt . . . . . 0 N--CA 1.495 1.789 0 O-C-N 121.202 -1.176 . . . . 0.0 110.212 179.982 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mtp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.95 115.28 4.29 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.404 1.213 . . . . 0.0 110.468 -179.964 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.411 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 18.2 mtmt -136.87 145.82 44.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.205 -0.934 . . . . 0.0 110.05 179.99 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.415 ' CD2' ' HD3' ' A' ' 21' ' ' ARG . 75.9 t80 -107.74 161.36 14.96 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.132 -0.98 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -133.83 134.25 42.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.251 -0.906 . . . . 0.0 110.157 -179.714 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.8 t -114.59 96.51 5.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.154 -0.966 . . . . 0.0 110.158 179.603 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.56 -35.99 61.36 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.985 -1.072 . . . . 0.0 110.385 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CE2' HG12 ' A' ' 34' ' ' VAL . 92.6 m-85 -61.24 -32.57 72.37 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.033 -1.042 . . . . 0.0 110.132 179.222 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.4 m -97.08 -4.58 39.25 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.954 -1.091 . . . . 0.0 112.163 -179.982 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.47 39.67 30.3 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.371 -1.456 . . . . 0.0 110.442 -179.698 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.98 171.61 13.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.307 -0.871 . . . . 0.0 110.051 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 12.9 t80 -118.45 133.21 56.06 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.254 -0.904 . . . . 0.0 110.328 -179.753 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -89.11 165.65 14.36 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.185 -0.947 . . . . 0.0 109.752 179.588 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 t -98.83 -29.92 12.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.134 -0.979 . . . . 0.0 111.698 -179.567 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 46.9 m-70 -111.05 146.36 36.87 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.877 -1.139 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.11 93.19 3.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.3 178.69 1.37 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.234 -0.916 . . . . 0.0 110.172 -179.594 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.425 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.15 -30.72 15.71 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.442 1.233 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.3 OUTLIER -89.73 -40.38 12.55 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.996 -1.065 . . . . 0.0 109.988 179.647 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 90.3 t -60.06 -50.46 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.641 179.813 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.415 ' HD3' ' CD2' ' A' ' 4' ' ' PHE . 19.7 mtt180 -58.86 -50.75 72.85 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.684 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -61.66 -40.29 94.41 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.17 -0.957 . . . . 0.0 108.832 178.817 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 19' ' ' SER . 85.7 m -54.53 -43.31 71.81 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.1 -1.0 . . . . 0.0 108.358 178.223 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -62.48 -37.78 87.33 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.008 177.814 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.07 48.35 1.0 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.133 -0.98 . . . . 0.0 110.442 -179.82 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.01 38.02 3.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.118 -0.989 . . . . 0.0 110.241 179.757 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.54 128.17 3.28 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.1 ttm105 -54.61 -28.5 47.05 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.144 -1.209 . . . . 0.0 110.361 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -59.15 -35.56 73.71 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.883 -1.135 . . . . 0.0 110.392 179.772 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -51.4 -39.1 56.53 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.023 -1.048 . . . . 0.0 110.5 -179.611 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -62.67 -55.6 25.36 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.136 -0.977 . . . . 0.0 109.128 179.406 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -60.13 -39.25 85.62 Favored 'General case' 0 N--CA 1.509 2.517 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.159 178.807 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -57.36 -37.14 72.15 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.301 -0.875 . . . . 0.0 110.053 179.232 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.424 HG12 ' CE2' ' A' ' 8' ' ' TYR . 73.0 t -56.86 -37.09 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.022 -1.049 . . . . 0.0 110.156 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.433 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.8 ttpt -54.13 -40.79 67.71 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.913 -1.117 . . . . 0.0 109.718 179.445 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.95 -28.63 66.46 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.359 178.911 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.74 -53.11 16.79 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.888 -1.132 . . . . 0.0 110.134 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.433 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.7 p90 -99.91 32.66 2.83 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.208 -0.933 . . . . 0.0 111.294 179.625 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -74.17 -35.97 64.05 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.73 -1.231 . . . . 0.0 110.258 179.184 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -107.28 27.0 9.51 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.121 -0.987 . . . . 0.0 111.091 179.61 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.448 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 10.6 t90 -109.45 -55.81 2.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.055 -1.028 . . . . 0.0 110.047 179.922 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.448 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.7 mtm -141.58 57.73 1.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.224 -0.923 . . . . 0.0 109.889 179.67 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -51.18 -36.21 40.0 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.056 -1.027 . . . . 0.0 110.97 -179.711 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -53.36 -58.69 6.22 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.966 -1.084 . . . . 0.0 110.511 -179.852 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.82 87.46 1.92 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.161 -0.962 . . . . 0.0 110.155 179.892 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.49 71.5 1.46 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.156 -0.965 . . . . 0.0 110.546 -179.888 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -144.3 34.89 1.2 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.162 -0.961 . . . . 0.0 110.573 179.426 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -53.42 2.65 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.204 -0.935 . . . . 0.0 109.393 179.192 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.24 65.04 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 111.249 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 51.1 mm -76.85 -51.97 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 120.647 -1.283 . . . . 0.0 109.787 179.806 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.432 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 71.1 m-20 -61.2 -39.66 91.04 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.239 -0.913 . . . . 0.0 110.116 179.884 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -57.12 -37.69 72.34 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.072 -1.018 . . . . 0.0 110.507 -179.794 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.9 m -92.46 -44.48 8.64 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.067 -1.021 . . . . 0.0 110.347 179.96 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.432 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 74.3 p -61.25 -39.37 90.07 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 110.085 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.95 70.0 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.098 -1.001 . . . . 0.0 110.12 179.827 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.23 28.57 3.57 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.07 -1.019 . . . . 0.0 111.651 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.93 -40.39 10.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.788 -1.195 . . . . 0.0 109.978 179.637 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -108.9 -51.77 2.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.203 -0.936 . . . . 0.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 54.35 51.61 13.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.005 -1.059 . . . . 0.0 110.638 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.19 44.69 1.44 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.933 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.196 -1.179 . . . . 0.0 110.203 -179.923 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 ptt? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.52 169.91 20.67 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.439 1.231 . . . . 0.0 110.386 179.954 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.7 mttt 55.55 170.89 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.308 -0.87 . . . . 0.0 110.713 -179.964 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -123.78 162.38 23.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.15 -0.969 . . . . 0.0 110.308 -179.441 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -138.15 134.19 34.26 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.205 -0.935 . . . . 0.0 110.47 -179.603 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.2 t -112.86 94.2 4.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.215 -0.928 . . . . 0.0 109.975 179.475 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -51.9 -36.05 47.48 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 121.068 -1.02 . . . . 0.0 110.569 179.95 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CE2' HG12 ' A' ' 34' ' ' VAL . 84.0 m-85 -61.2 -32.07 71.83 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.184 -0.947 . . . . 0.0 110.163 179.225 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.9 m -98.74 -4.38 33.62 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.073 -1.017 . . . . 0.0 112.358 -179.864 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.57 38.71 28.81 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.33 -1.481 . . . . 0.0 110.568 -179.642 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -139.61 170.9 15.05 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 109.637 179.785 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -117.77 135.6 53.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.16 -0.963 . . . . 0.0 110.695 -179.592 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -100.82 133.36 45.42 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.174 -0.954 . . . . 0.0 109.483 179.391 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.2 t -75.87 -24.08 55.67 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.187 -0.945 . . . . 0.0 111.881 -179.392 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 46.8 m-70 -110.93 137.8 48.11 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.761 -1.212 . . . . 0.0 110.428 -179.842 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -125.51 85.99 2.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.671 179.659 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.414 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.04 179.69 1.3 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.268 -0.895 . . . . 0.0 109.906 -179.496 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.01 -31.7 14.57 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.329 1.173 . . . . 0.0 110.896 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 69.5 m -86.13 -46.57 10.31 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.876 -1.14 . . . . 0.0 109.752 179.305 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.54 -52.72 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.164 -0.96 . . . . 0.0 109.687 179.739 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -56.39 -52.41 64.7 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.025 -1.047 . . . . 0.0 109.634 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -60.62 -39.9 89.89 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.941 178.82 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 87.1 m -55.31 -43.53 74.94 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.044 -1.035 . . . . 0.0 108.313 178.272 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -62.67 -38.87 92.03 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.845 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.15 50.03 1.07 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.318 -0.864 . . . . 0.0 110.399 -179.922 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.33 37.47 3.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -0.987 . . . . 0.0 110.336 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.18 127.16 2.78 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.94 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.27 -28.65 43.24 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.123 -1.222 . . . . 0.0 110.331 179.092 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -59.18 -33.36 70.85 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 120.949 -1.094 . . . . 0.0 110.57 179.735 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 15.5 t-80 -50.58 -39.63 50.13 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.979 -1.076 . . . . 0.0 110.803 -179.545 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -54.77 33.15 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.118 -0.988 . . . . 0.0 109.127 179.368 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.84 -39.16 88.04 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.203 -0.936 . . . . 0.0 109.052 178.693 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -56.27 -37.29 69.6 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.209 -0.932 . . . . 0.0 110.103 179.057 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CE2' ' A' ' 8' ' ' TYR . 77.0 t -55.1 -36.24 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.062 -1.024 . . . . 0.0 110.099 179.609 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 30.9 tttt -54.75 -40.9 69.79 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.928 -1.107 . . . . 0.0 109.714 179.328 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.77 -28.02 65.54 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.372 178.975 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -72.29 -52.79 14.69 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.869 -1.145 . . . . 0.0 110.314 -179.966 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 36.8 p90 -99.28 31.12 3.2 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.11 -0.994 . . . . 0.0 111.5 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.85 -39.53 66.46 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.708 -1.245 . . . . 0.0 110.014 179.251 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -118.81 26.07 9.8 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.265 -0.897 . . . . 0.0 111.235 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 22.8 t90 -69.54 -42.49 74.57 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.962 -1.086 . . . . 0.0 110.078 -179.88 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.445 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.0 ttm -151.09 40.63 0.72 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.166 -0.959 . . . . 0.0 110.532 -179.974 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 52.57 -172.05 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.946 -1.096 . . . . 0.0 110.734 179.869 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 53.56 -172.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.102 -0.999 . . . . 0.0 110.67 -179.957 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -114.24 130.69 56.63 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.231 -0.918 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -120.19 75.29 1.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.291 -0.88 . . . . 0.0 110.114 -179.981 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.54 37.11 2.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.118 -0.989 . . . . 0.0 110.4 179.703 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.1 m -113.91 -55.34 2.51 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.153 -0.967 . . . . 0.0 109.687 179.485 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.03 -21.41 63.58 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.208 -0.933 . . . . 0.0 111.5 179.469 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.404 ' O ' ' OG1' ' A' ' 54' ' ' THR . 44.8 mm -67.21 -41.73 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.568 -1.332 . . . . 0.0 109.424 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 3.0 m-20 -63.91 -39.81 95.03 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 179.887 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -66.78 -36.43 82.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.148 -0.97 . . . . 0.0 110.33 179.856 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.7 m -85.46 -40.05 16.83 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.071 -1.018 . . . . 0.0 110.088 179.747 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 21.9 p -58.55 -37.44 75.71 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.007 . . . . 0.0 110.21 179.799 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.37 -40.58 11.37 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.105 -0.997 . . . . 0.0 110.156 179.802 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.85 52.27 1.32 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.085 -1.009 . . . . 0.0 110.498 179.616 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -92.89 -57.76 2.55 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.181 -0.949 . . . . 0.0 110.242 179.672 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -153.5 40.12 0.51 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.622 -179.908 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -121.97 69.13 0.94 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.22 -0.925 . . . . 0.0 110.19 -180.0 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 109.33 109.97 3.3 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.983 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 O-C-N 121.256 -1.144 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ptm . . . . . 0 N--CA 1.498 1.954 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 77.3 1.96 Allowed 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.252 1.133 . . . . 0.0 110.349 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.1 mtmt -137.4 158.5 44.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.16 -0.962 . . . . 0.0 110.034 179.896 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -114.91 162.04 17.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.126 -0.984 . . . . 0.0 110.405 -179.51 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -137.25 133.05 34.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.243 -0.911 . . . . 0.0 110.01 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 t -112.2 93.21 4.34 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.118 179.475 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -52.29 -36.03 51.87 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 121.026 -1.046 . . . . 0.0 110.367 179.813 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.427 ' CE2' HG12 ' A' ' 34' ' ' VAL . 85.4 m-85 -60.28 -30.88 69.74 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.205 -0.935 . . . . 0.0 110.196 178.982 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.1 m -100.81 -2.08 33.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.012 -1.055 . . . . 0.0 112.275 -179.713 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.88 38.34 26.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.407 -1.433 . . . . 0.0 110.664 -179.653 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -140.2 168.45 19.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.213 -0.929 . . . . 0.0 109.762 179.737 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -118.34 142.59 47.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.2 -0.938 . . . . 0.0 110.619 -179.524 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.5 mp -101.37 160.64 14.25 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.211 -0.931 . . . . 0.0 109.769 179.465 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.409 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -102.51 -30.35 11.03 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.191 -0.943 . . . . 0.0 112.045 -179.286 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.409 ' CD2' HG21 ' A' ' 14' ' ' THR . 48.1 m-70 -113.57 111.76 22.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.79 -1.194 . . . . 0.0 110.533 -179.597 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -92.95 67.17 4.3 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.162 -0.961 . . . . 0.0 110.468 179.837 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.415 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -107.39 178.14 1.15 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.155 -0.966 . . . . 0.0 110.009 179.684 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.39 -30.7 15.07 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.332 1.175 . . . . 0.0 111.276 -179.816 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.412 ' O ' ' OG1' ' A' ' 23' ' ' THR . 45.9 m -86.89 -41.13 14.24 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.86 -1.15 . . . . 0.0 110.122 179.865 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.7 t -58.45 -57.04 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 O-C-N 121.073 -1.017 . . . . 0.0 109.914 179.893 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -53.69 -50.21 66.35 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.947 -1.095 . . . . 0.0 110.094 -179.824 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -62.97 -41.07 99.44 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.741 178.781 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 19' ' ' SER . 73.6 m -55.05 -43.35 73.72 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.234 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -63.12 -38.49 91.37 Favored 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.832 177.908 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 t -97.6 49.55 1.04 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.366 -179.894 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -117.38 37.79 3.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.06 -1.025 . . . . 0.0 110.375 179.853 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.11 127.27 2.82 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.792 -1.323 . . . . 0.0 109.792 -179.906 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -54.35 -28.59 43.92 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.151 -1.205 . . . . 0.0 110.323 179.064 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -59.36 -33.63 71.4 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.982 -1.073 . . . . 0.0 110.53 179.764 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -50.5 -38.71 45.71 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.98 -1.075 . . . . 0.0 110.793 -179.477 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -62.88 -55.63 24.39 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.165 -0.96 . . . . 0.0 109.153 179.31 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -59.4 -38.56 80.89 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.232 -0.917 . . . . 0.0 109.215 178.661 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.27 -38.26 70.95 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.204 -0.935 . . . . 0.0 110.116 179.327 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.427 HG12 ' CE2' ' A' ' 8' ' ' TYR . 75.9 t -58.03 -35.25 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.578 0 O-C-N 121.027 -1.045 . . . . 0.0 110.152 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 22.1 tttt -52.59 -40.58 62.78 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 121.006 -1.059 . . . . 0.0 110.075 179.613 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -57.94 -28.2 64.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.279 -0.888 . . . . 0.0 110.532 178.971 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -71.88 -52.37 17.67 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.856 -1.153 . . . . 0.0 110.386 -179.882 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.8 p90 -99.49 34.1 2.3 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.033 -1.042 . . . . 0.0 111.479 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -80.35 -39.88 27.73 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.758 -1.214 . . . . 0.0 110.074 179.035 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -117.75 34.64 5.05 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.202 -0.936 . . . . 0.0 110.533 179.711 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -92.21 -48.28 6.78 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.122 -0.986 . . . . 0.0 110.539 -179.751 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 tpp -146.02 -60.83 0.32 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.146 -0.971 . . . . 0.0 110.823 -179.785 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -121.8 -175.84 3.19 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.074 -1.016 . . . . 0.0 110.607 -179.603 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -99.89 -37.14 9.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.197 -0.939 . . . . 0.0 110.976 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -104.79 78.83 1.47 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.917 -1.115 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.416 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -116.46 74.76 0.92 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.213 -0.929 . . . . 0.0 110.011 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.9 35.06 3.37 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.206 -0.933 . . . . 0.0 110.673 179.843 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 m -109.8 -54.5 2.55 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.173 -0.954 . . . . 0.0 109.254 179.084 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.72 -20.92 64.02 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.266 -0.896 . . . . 0.0 111.313 179.184 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.412 HG13 ' CE1' ' A' ' 38' ' ' TYR . 47.2 mm -72.72 -40.71 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 120.701 -1.249 . . . . 0.0 109.663 179.703 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.435 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 10.4 t70 -74.06 -40.76 62.57 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.196 -0.94 . . . . 0.0 109.911 179.919 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -58.33 -34.41 70.58 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.211 -0.93 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.6 m -89.93 -44.79 9.66 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.014 -1.054 . . . . 0.0 110.263 -179.942 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.435 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 22.9 p -57.4 -31.53 65.92 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.114 -0.991 . . . . 0.0 110.822 179.945 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.91 -33.71 15.5 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.803 -1.185 . . . . 0.0 111.089 -179.907 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.89 -38.53 15.55 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.913 -1.117 . . . . 0.0 110.451 -179.89 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -53.23 -36.46 61.06 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.998 -1.064 . . . . 0.0 110.691 -179.953 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -111.67 39.16 2.42 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.061 -1.025 . . . . 0.0 110.354 179.855 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -153.14 72.11 0.93 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.191 -0.943 . . . . 0.0 110.528 179.991 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.42 -94.13 0.23 Allowed Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.198 -1.177 . . . . 0.0 110.225 179.993 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.4 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.105 0 CA-C-O 119.856 -0.116 . . . . 0.0 110.778 . . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 1' ' ' MET . 49.7 Cg_endo -80.02 135.94 11.41 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 O-C-N 123.178 1.094 . . . . 0.0 110.446 -179.768 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -139.55 160.3 40.18 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.221 -0.924 . . . . 0.0 110.091 179.992 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.411 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 85.8 t80 -112.08 161.51 16.42 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.207 -179.931 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -136.72 132.38 34.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.237 -0.914 . . . . 0.0 110.183 -179.573 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.0 t -111.97 94.46 4.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.095 -1.003 . . . . 0.0 110.083 179.526 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.08 -35.82 48.84 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.133 -0.979 . . . . 0.0 110.538 179.901 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.424 ' CE2' HG12 ' A' ' 34' ' ' VAL . 83.1 m-85 -61.6 -33.36 73.77 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.104 -0.997 . . . . 0.0 110.001 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.3 m -96.12 -3.43 44.58 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.102 -0.999 . . . . 0.0 112.176 179.968 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 52.68 39.33 28.26 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.379 -1.451 . . . . 0.0 110.538 -179.72 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.44 172.72 12.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.942 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -118.89 139.08 52.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.281 -0.887 . . . . 0.0 110.611 -179.62 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -99.08 168.24 10.2 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.209 -0.932 . . . . 0.0 109.626 179.462 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.417 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.79 -30.47 12.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.122 -0.986 . . . . 0.0 111.6 -179.601 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.417 ' CD2' HG21 ' A' ' 14' ' ' THR . 45.2 m-70 -114.85 147.73 39.5 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.892 -1.13 . . . . 0.0 110.214 -179.89 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -126.55 90.6 3.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.197 -0.939 . . . . 0.0 109.801 179.94 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.32 178.32 1.48 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.227 -0.92 . . . . 0.0 110.177 -179.708 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 41.7 Cg_endo -70.12 -31.35 19.08 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.448 1.236 . . . . 0.0 110.802 179.856 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.41 -36.97 23.84 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.056 -1.027 . . . . 0.0 110.057 179.283 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.97 -48.81 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 121.029 -1.044 . . . . 0.0 109.821 179.677 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 21.6 mtm180 -57.27 -52.26 66.06 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.072 -1.018 . . . . 0.0 109.764 179.951 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -59.17 -39.52 82.76 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.13 -0.982 . . . . 0.0 109.203 179.056 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.3 m -55.98 -43.44 77.58 Favored 'General case' 0 N--CA 1.511 2.62 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.237 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -63.04 -40.27 97.21 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.889 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.6 55.83 2.27 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.395 -0.815 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.2 37.34 4.03 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.122 -0.986 . . . . 0.0 110.371 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.6 127.3 2.69 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.932 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -28.11 47.31 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.116 -1.226 . . . . 0.0 110.344 179.138 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -60.3 -33.18 71.99 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.939 -1.101 . . . . 0.0 110.626 179.775 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -49.95 -37.91 34.16 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.955 -1.091 . . . . 0.0 110.781 -179.662 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -62.61 -56.41 18.1 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.086 -1.008 . . . . 0.0 109.166 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.04 -38.59 79.68 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.223 -0.923 . . . . 0.0 109.156 178.764 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -56.59 -37.86 71.21 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 110.035 179.28 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.424 HG12 ' CE2' ' A' ' 8' ' ' TYR . 77.5 t -57.99 -36.34 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.127 -0.983 . . . . 0.0 109.982 179.756 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.7 ttpm? -54.89 -42.29 71.95 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.921 -1.112 . . . . 0.0 109.611 179.488 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.08 -28.33 64.48 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.298 -0.876 . . . . 0.0 110.373 178.899 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -70.23 -52.28 24.35 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.915 -1.116 . . . . 0.0 110.292 -179.841 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.4 p90 -99.77 34.39 2.28 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.096 -1.003 . . . . 0.0 111.358 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.71 -37.28 24.95 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.714 -1.241 . . . . 0.0 110.154 178.83 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -110.32 29.43 7.69 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 179.587 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.1 t90 -90.77 -40.23 11.93 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.014 -1.054 . . . . 0.0 109.973 179.878 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -154.89 -66.46 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.199 -0.938 . . . . 0.0 110.483 179.84 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -124.26 -164.34 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.196 -0.94 . . . . 0.0 110.09 179.971 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -126.9 38.71 4.05 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.104 -0.997 . . . . 0.0 110.378 179.725 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -159.13 75.05 0.67 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.224 -0.922 . . . . 0.0 110.504 179.886 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.17 82.96 1.96 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.137 -0.977 . . . . 0.0 110.349 -179.837 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -109.34 36.08 3.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.119 -0.988 . . . . 0.0 110.33 179.617 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.5 m -115.05 -55.55 2.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.088 -1.007 . . . . 0.0 109.608 179.416 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -22.31 61.97 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.222 -0.924 . . . . 0.0 111.153 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.421 HD11 HG22 ' A' ' 50' ' ' ILE . 45.9 mm -66.39 -39.85 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 120.646 -1.284 . . . . 0.0 109.291 179.191 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -72.35 -36.16 68.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.226 -0.921 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -76.48 -35.6 58.31 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.036 -1.04 . . . . 0.0 110.615 179.93 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -78.46 -39.85 37.31 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.053 -1.029 . . . . 0.0 110.136 179.944 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 18.6 p -60.55 -39.56 88.38 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.138 -0.976 . . . . 0.0 110.144 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.97 -43.21 9.57 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.191 -0.943 . . . . 0.0 110.109 179.759 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.07 57.49 2.41 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.167 -0.958 . . . . 0.0 110.096 179.512 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -92.79 -39.91 10.96 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.241 -0.912 . . . . 0.0 110.247 179.86 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -114.19 48.86 1.05 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.152 -0.967 . . . . 0.0 110.247 179.991 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -130.84 -60.61 0.97 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.259 -0.9 . . . . 0.0 110.137 179.953 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 104.24 68.14 0.74 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.991 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.501 2.09 0 O-C-N 121.064 -1.256 . . . . 0.0 110.814 179.969 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.4 mtm . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.52 121.47 7.46 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.455 1.239 . . . . 0.0 110.464 -179.962 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.424 ' HB2' ' OH ' ' A' ' 12' ' ' TYR . 32.4 mttm -130.74 157.88 41.63 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.963 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -113.1 161.86 16.61 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.082 -1.011 . . . . 0.0 110.292 -179.626 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -131.59 137.46 48.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.237 -0.914 . . . . 0.0 110.232 -179.82 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.08 97.9 6.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.145 -0.972 . . . . 0.0 109.989 179.512 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -51.93 -35.95 47.48 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.061 -1.025 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.414 ' CE2' HG12 ' A' ' 34' ' ' VAL . 88.8 m-85 -63.19 -32.26 73.61 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.091 -1.006 . . . . 0.0 110.167 179.38 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.8 m -98.2 -8.94 26.47 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.058 -1.026 . . . . 0.0 112.024 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 54.87 41.0 32.25 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.344 -1.472 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.09 173.28 11.66 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.246 -0.909 . . . . 0.0 110.025 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.424 ' OH ' ' HB2' ' A' ' 3' ' ' LYS . 5.1 t80 -120.08 131.52 55.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.577 -179.6 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -88.84 170.45 10.72 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.143 -0.973 . . . . 0.0 109.7 179.48 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.414 HG21 ' CD2' ' A' ' 15' ' ' HIS . 15.2 t -96.93 -31.29 12.63 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.302 -0.873 . . . . 0.0 111.375 -179.83 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CD2' HG21 ' A' ' 14' ' ' THR . 50.4 m-70 -112.24 146.75 37.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.824 -1.173 . . . . 0.0 110.125 179.916 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -126.27 93.96 3.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 109.861 179.919 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.428 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -148.63 178.47 1.45 Allowed Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.182 -0.949 . . . . 0.0 110.312 -179.533 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.46 -32.87 14.9 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.384 1.202 . . . . 0.0 110.852 179.873 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.406 ' O ' ' OG1' ' A' ' 23' ' ' THR . 29.8 m -83.99 -39.87 19.16 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.965 -1.085 . . . . 0.0 109.839 179.396 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t -65.74 -47.39 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 O-C-N 121.081 -1.012 . . . . 0.0 109.642 179.715 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -57.19 -50.83 71.61 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.127 -0.983 . . . . 0.0 109.565 179.777 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -61.48 -40.96 96.46 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.22 -0.925 . . . . 0.0 108.732 178.803 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.0 m -54.19 -43.22 70.54 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.178 -0.951 . . . . 0.0 108.524 178.33 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -62.33 -37.71 86.67 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.348 -0.845 . . . . 0.0 108.853 178.076 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -96.58 51.66 1.18 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.202 -0.936 . . . . 0.0 110.317 -179.861 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m -117.1 37.64 3.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.28 128.34 3.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.919 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -28.61 45.54 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.136 -1.214 . . . . 0.0 110.351 179.172 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -59.37 -34.9 72.97 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.029 -1.044 . . . . 0.0 110.393 179.764 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.22 -39.01 55.63 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.961 -1.087 . . . . 0.0 110.571 -179.613 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -61.9 -55.09 33.29 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.114 179.27 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -38.84 83.6 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.217 -0.927 . . . . 0.0 109.193 178.65 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.35 -36.96 71.85 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.091 -1.005 . . . . 0.0 110.203 179.156 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.414 HG12 ' CE2' ' A' ' 8' ' ' TYR . 72.2 t -57.85 -35.39 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.08 -1.012 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.8 mmmt -52.65 -39.44 61.81 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.877 -1.14 . . . . 0.0 109.957 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.44 -28.82 65.64 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 178.9 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -73.28 -54.11 9.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.853 -1.154 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 31.6 p90 -98.56 31.73 2.78 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.088 -1.008 . . . . 0.0 111.508 179.88 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.88 -38.41 64.4 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.739 -1.226 . . . . 0.0 109.777 178.948 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.4 22.58 13.95 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.253 -0.904 . . . . 0.0 111.114 179.176 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 17.3 t90 -101.5 -49.31 4.07 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.908 -1.12 . . . . 0.0 109.804 179.662 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.434 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 28.2 mmt -111.98 -53.02 2.75 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.245 -0.91 . . . . 0.0 110.245 179.701 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 54.79 39.31 31.33 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.986 -1.071 . . . . 0.0 110.674 179.99 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -149.04 -66.29 0.23 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.179 -0.95 . . . . 0.0 110.439 179.888 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -166.89 77.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.193 -0.942 . . . . 0.0 110.851 -179.982 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.42 73.4 1.53 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.233 -0.917 . . . . 0.0 110.301 -179.799 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.09 33.62 5.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.162 -0.962 . . . . 0.0 110.524 179.445 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.1 p -107.27 -50.82 3.01 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.096 -1.002 . . . . 0.0 109.678 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.36 -21.84 60.45 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.219 -0.926 . . . . 0.0 111.527 179.369 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.457 HG21 HD11 ' A' ' 50' ' ' ILE . 50.5 mm -76.66 -39.72 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 120.716 -1.24 . . . . 0.0 109.925 179.777 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.428 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 31.7 t0 -80.39 -40.72 25.97 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.153 -0.967 . . . . 0.0 109.958 179.758 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -58.06 -33.24 68.82 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -0.91 . . . . 0.0 110.685 179.816 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.4 m -86.76 -41.3 14.23 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.997 -1.064 . . . . 0.0 110.109 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 27.4 p -59.38 -37.68 78.54 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.124 -0.985 . . . . 0.0 110.134 179.897 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.48 -40.98 11.09 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.14 -0.975 . . . . 0.0 110.154 179.761 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.24 53.98 1.59 Allowed 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.151 -0.968 . . . . 0.0 110.293 179.597 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -93.25 -48.28 6.52 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.196 -0.94 . . . . 0.0 110.062 179.785 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -132.52 74.94 1.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.234 -0.916 . . . . 0.0 110.098 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -124.08 -60.08 1.45 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.106 -0.996 . . . . 0.0 110.247 -179.948 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 113.85 70.62 0.53 Allowed Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt . . . . . 0 N--CA 1.496 1.866 0 O-C-N 121.228 -1.16 . . . . 0.0 110.286 -179.946 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.47 145.91 43.44 Favored 'Trans proline' 0 C--N 1.318 -1.074 0 O-C-N 123.374 1.197 . . . . 0.0 110.334 179.952 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.7 mttt -147.61 144.33 28.35 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 110.561 -179.835 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -112.69 155.28 24.77 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.213 -0.93 . . . . 0.0 109.816 179.552 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -134.28 139.55 45.8 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.158 -0.964 . . . . 0.0 110.532 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.0 t -111.34 98.39 7.45 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.258 -0.901 . . . . 0.0 110.185 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -53.52 -35.79 61.05 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.148 -0.97 . . . . 0.0 110.462 179.72 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.422 ' CE2' HG12 ' A' ' 34' ' ' VAL . 81.1 m-85 -63.01 -33.12 74.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.105 -0.997 . . . . 0.0 110.306 179.44 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.4 m -98.75 -2.83 37.13 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.005 -1.059 . . . . 0.0 112.082 179.855 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 53.8 37.98 27.57 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.37 -1.456 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -131.32 171.66 13.08 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.168 -0.957 . . . . 0.0 109.98 179.697 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -125.06 107.64 11.01 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.905 . . . . 0.0 110.12 179.852 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -67.31 166.74 13.74 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.167 -0.958 . . . . 0.0 109.854 -179.999 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.408 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.19 -30.42 11.93 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.266 -0.896 . . . . 0.0 111.628 -179.694 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.408 ' CD2' HG21 ' A' ' 14' ' ' THR . 42.0 m-70 -115.85 139.76 49.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.819 -1.175 . . . . 0.0 110.184 -179.897 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -116.02 92.04 3.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.255 -0.903 . . . . 0.0 109.901 179.746 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.411 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -137.83 177.92 1.92 Allowed Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 -179.637 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.7 Cg_endo -70.32 -31.41 18.09 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.364 1.191 . . . . 0.0 110.974 179.995 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.416 ' O ' ' OG1' ' A' ' 23' ' ' THR . 0.2 OUTLIER -87.6 -43.78 11.72 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.972 -1.08 . . . . 0.0 109.842 179.501 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.8 t -60.12 -49.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.636 179.842 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtp-105 -59.61 -50.85 72.26 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.038 -1.039 . . . . 0.0 109.332 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.07 -39.96 91.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.214 -0.929 . . . . 0.0 108.85 178.821 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 19' ' ' SER . 86.9 m -54.37 -42.84 70.79 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.057 -1.027 . . . . 0.0 108.611 178.32 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -62.73 -37.47 86.69 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 119.63 -0.828 . . . . 0.0 109.109 178.066 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.8 49.54 1.09 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.156 -0.965 . . . . 0.0 110.529 -179.727 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.89 40.31 2.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.096 -1.002 . . . . 0.0 109.782 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.37 148.96 19.95 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.666 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -79.64 -9.11 59.58 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.298 -1.119 . . . . 0.0 111.064 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -91.47 -21.34 20.97 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.678 -1.264 . . . . 0.0 111.449 179.657 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -48.49 -37.52 17.67 Favored 'General case' 0 N--CA 1.518 2.953 0 O-C-N 120.743 -1.223 . . . . 0.0 110.968 -179.559 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -63.11 -54.26 40.71 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.092 -1.005 . . . . 0.0 108.981 179.241 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.26 -39.2 85.99 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.0 178.609 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.88 -37.37 68.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.167 -0.958 . . . . 0.0 110.103 179.218 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.422 HG12 ' CE2' ' A' ' 8' ' ' TYR . 69.4 t -56.13 -35.34 41.59 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 O-C-N 120.993 -1.067 . . . . 0.0 110.066 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.5 tptm -52.4 -39.93 61.5 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.905 -1.122 . . . . 0.0 110.056 179.562 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.67 -29.6 64.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -69.96 -53.04 19.56 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.901 -1.124 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -100.0 34.76 2.21 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.124 -0.985 . . . . 0.0 111.227 179.793 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.08 -35.86 23.44 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.744 -1.222 . . . . 0.0 110.3 178.978 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -105.17 23.23 13.99 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.043 -1.035 . . . . 0.0 111.289 179.553 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 14.9 t90 -99.76 -45.28 5.8 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.855 -1.153 . . . . 0.0 110.152 179.89 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -124.34 42.18 3.32 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.125 -0.984 . . . . 0.0 110.094 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.12 -75.46 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.294 -0.878 . . . . 0.0 110.919 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -168.97 44.36 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.775 -1.203 . . . . 0.0 111.124 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -147.47 75.38 1.36 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 179.954 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -155.93 74.57 0.86 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.25 -0.906 . . . . 0.0 110.74 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -118.43 36.62 4.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.178 -0.951 . . . . 0.0 110.518 179.676 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -113.22 -54.94 2.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.183 -0.948 . . . . 0.0 109.721 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.55 63.54 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.288 -0.883 . . . . 0.0 111.328 179.405 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 HD13 ' CD1' ' A' ' 38' ' ' TYR . 46.8 mm -68.88 -40.93 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 120.693 -1.255 . . . . 0.0 109.464 179.597 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.75 -41.35 17.72 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.17 -0.956 . . . . 0.0 109.76 179.663 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -60.86 -32.41 71.83 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.288 -0.883 . . . . 0.0 110.457 179.676 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 83.3 m -88.31 -39.85 14.05 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.977 -1.077 . . . . 0.0 110.323 -179.975 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' ' 50' ' ' ILE . 31.4 p -67.82 -39.91 83.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.106 -0.996 . . . . 0.0 109.901 179.761 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.13 -33.73 63.13 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.113 -0.992 . . . . 0.0 110.886 179.969 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -90.2 -39.51 12.76 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.065 -1.022 . . . . 0.0 110.273 179.976 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -57.3 -38.33 73.83 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.152 -0.968 . . . . 0.0 110.25 -179.973 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -112.97 -59.44 2.02 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.057 -1.027 . . . . 0.0 110.207 179.874 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 52.52 70.38 0.58 Allowed 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.091 -1.006 . . . . 0.0 110.777 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -120.51 41.74 1.87 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.1 tttt . . . . . 0 N--CA 1.494 1.769 0 O-C-N 121.219 -1.165 . . . . 0.0 110.18 -179.964 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.0 mtm . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.92 148.19 45.12 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.347 1.182 . . . . 0.0 110.427 -179.986 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 12' ' ' TYR . 91.4 mttt -127.67 149.69 50.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.19 -0.944 . . . . 0.0 110.147 -179.994 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -104.57 148.85 26.05 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.3 -0.875 . . . . 0.0 109.465 179.47 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -125.08 130.15 51.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.2 -0.938 . . . . 0.0 110.542 -179.407 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.0 t -109.98 93.87 4.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.182 -0.949 . . . . 0.0 109.686 179.375 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -51.74 -36.41 47.04 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 121.158 -0.964 . . . . 0.0 111.035 -179.427 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.429 ' CD2' HG23 ' A' ' 34' ' ' VAL . 27.8 m-85 -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.053 -1.029 . . . . 0.0 110.114 179.461 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -96.42 -4.23 42.12 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.002 -1.061 . . . . 0.0 111.952 179.605 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 53.68 47.25 24.21 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.428 -1.42 . . . . 0.0 110.66 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 t -140.95 171.26 14.32 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.265 -0.897 . . . . 0.0 110.373 179.852 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE2' ' CD ' ' A' ' 3' ' ' LYS . 12.1 t80 -126.66 104.68 8.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.991 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.4 mp -65.22 163.48 15.16 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.868 -179.739 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.4 t -99.3 -31.05 11.89 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.199 -0.938 . . . . 0.0 111.591 -179.611 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 -114.23 136.42 52.98 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.823 -1.173 . . . . 0.0 110.076 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -114.31 92.09 3.84 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.155 -0.966 . . . . 0.0 109.849 179.66 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.402 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.12 179.04 1.47 Allowed Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.232 -0.918 . . . . 0.0 109.983 -179.601 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.16 -30.84 15.52 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.293 1.154 . . . . 0.0 111.028 179.994 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 6.1 m -89.27 -43.73 10.76 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.942 -1.099 . . . . 0.0 109.887 179.607 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.9 t -59.26 -52.48 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.58 0 O-C-N 121.121 -0.987 . . . . 0.0 109.833 179.832 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 mtp-105 -58.2 -50.08 74.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.135 -0.978 . . . . 0.0 109.511 179.817 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt -61.47 -40.06 93.16 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.291 -0.963 . . . . 0.0 108.88 178.72 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 79.4 m -54.29 -43.03 70.71 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.109 -0.994 . . . . 0.0 108.539 178.269 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -62.7 -37.91 88.34 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.96 177.961 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.92 52.09 1.15 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.178 -0.952 . . . . 0.0 110.188 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.37 38.05 3.36 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.051 -1.031 . . . . 0.0 110.392 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.78 126.47 2.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.976 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -53.95 -28.72 38.98 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.107 -1.231 . . . . 0.0 110.378 179.217 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -60.4 -31.54 70.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 0.0 110.645 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 14.3 t-80 -49.52 -37.97 28.86 Favored 'General case' 0 N--CA 1.516 2.832 0 O-C-N 120.933 -1.105 . . . . 0.0 110.964 -179.564 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -62.23 -54.23 43.78 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.072 -1.018 . . . . 0.0 109.118 179.3 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.38 -38.43 83.89 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.123 178.612 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -56.57 -37.65 70.87 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.274 -0.891 . . . . 0.0 110.18 179.321 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.429 HG23 ' CD2' ' A' ' 8' ' ' TYR . 95.1 t -59.62 -39.32 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.123 -0.986 . . . . 0.0 109.722 179.645 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 52.3 mttt -54.06 -40.91 67.59 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.016 -1.052 . . . . 0.0 109.606 179.331 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.42 -34.92 69.44 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.052 178.993 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -62.15 -52.56 63.36 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.002 -1.061 . . . . 0.0 109.602 179.649 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.425 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 49.8 p90 -100.94 38.0 1.63 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.276 -0.89 . . . . 0.0 110.781 179.412 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -87.0 -37.35 17.6 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.927 -1.108 . . . . 0.0 110.067 178.874 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.35 19.25 14.7 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.179 -0.951 . . . . 0.0 111.179 179.244 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 17.6 t90 -105.86 -55.98 2.25 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.809 -1.182 . . . . 0.0 109.971 179.704 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 5.1 tpp -143.14 57.98 1.4 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.864 . . . . 0.0 109.855 179.963 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.22 89.23 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.525 0 O-C-N 121.206 -0.934 . . . . 0.0 110.254 -179.69 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.08 -58.73 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.249 -0.907 . . . . 0.0 110.733 179.891 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -159.71 76.32 0.65 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.302 -0.873 . . . . 0.0 110.722 179.868 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.15 71.0 1.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.182 -0.949 . . . . 0.0 110.386 -179.816 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.67 32.81 5.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.174 -0.954 . . . . 0.0 110.657 179.406 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -104.07 -48.67 3.82 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.08 -1.012 . . . . 0.0 109.568 179.297 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -21.25 62.78 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.169 -0.957 . . . . 0.0 111.469 179.491 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.414 HD12 ' OH ' ' A' ' 8' ' ' TYR . 50.3 mm -82.12 -53.11 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 120.646 -1.284 . . . . 0.0 109.945 179.728 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.428 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 22.0 t0 -56.88 -39.57 74.6 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.135 -0.978 . . . . 0.0 110.32 -179.855 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -57.14 -36.57 70.87 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.148 -0.97 . . . . 0.0 110.54 -179.922 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m -91.64 -37.5 13.02 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.074 -1.016 . . . . 0.0 110.483 179.948 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.428 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 68.5 p -73.13 -34.69 66.25 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.081 -1.012 . . . . 0.0 110.538 179.972 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.26 -40.17 16.92 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.903 -1.123 . . . . 0.0 110.073 179.849 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.73 -34.49 67.56 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.071 -1.018 . . . . 0.0 110.622 179.918 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -87.58 -34.67 18.46 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.029 -1.044 . . . . 0.0 110.694 179.945 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -101.5 57.11 0.84 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.99 -1.069 . . . . 0.0 110.119 179.81 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -116.59 -56.96 2.24 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.062 -1.024 . . . . 0.0 110.104 179.856 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.99 -58.49 0.51 Allowed Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.93 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.3 mttm . . . . . 0 N--CA 1.494 1.757 0 O-C-N 121.278 -1.131 . . . . 0.0 110.155 179.964 . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.52 153.62 55.03 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.417 1.22 . . . . 0.0 110.523 179.966 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 20.3 mtmt -144.64 153.29 41.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.245 -0.909 . . . . 0.0 110.36 -179.946 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 21' ' ' ARG . 40.7 t80 -113.53 154.42 27.13 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.286 -0.884 . . . . 0.0 109.609 179.564 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -126.45 133.82 51.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.053 -1.029 . . . . 0.0 110.538 -179.851 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 45.9 t -109.8 97.7 7.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.502 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -54.32 -36.57 63.89 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.094 -1.004 . . . . 0.0 110.272 179.715 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.423 ' CE1' HG12 ' A' ' 34' ' ' VAL . 91.0 m-85 -59.84 -32.37 70.61 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.185 179.082 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.8 m -97.02 -1.81 44.7 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.984 -1.073 . . . . 0.0 112.098 -179.894 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.63 39.17 27.79 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.352 -1.468 . . . . 0.0 110.399 -179.589 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.3 t -145.83 175.31 10.51 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.174 -179.972 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -122.03 122.67 39.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.363 -0.835 . . . . 0.0 110.285 -179.624 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.408 HD23 ' CG ' ' A' ' 24' ' ' HIS . 4.2 mp -76.44 170.41 16.42 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.101 -0.999 . . . . 0.0 109.506 179.283 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.9 t -100.15 -29.4 12.51 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.173 -0.954 . . . . 0.0 111.799 -179.661 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -110.94 146.53 36.43 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.758 -1.214 . . . . 0.0 110.388 -179.91 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -125.38 93.68 3.93 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.772 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.411 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.75 176.7 2.08 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.25 -0.906 . . . . 0.0 110.27 -179.611 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -69.59 -32.08 19.99 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.401 1.211 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.416 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.7 t -86.05 -39.5 16.74 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.954 -1.091 . . . . 0.0 109.973 179.5 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.7 t -63.38 -47.39 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.208 -0.932 . . . . 0.0 109.595 179.751 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 mtt180 -58.29 -51.64 68.94 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.082 -1.011 . . . . 0.0 109.632 179.941 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -62.29 -41.13 98.24 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.789 179.012 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.416 ' OG1' ' O ' ' A' ' 19' ' ' SER . 96.8 m -55.68 -43.17 76.11 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.074 -1.016 . . . . 0.0 108.522 178.324 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.408 ' CG ' HD23 ' A' ' 13' ' ' LEU . 72.3 t60 -61.83 -35.35 77.98 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.644 -0.823 . . . . 0.0 109.288 178.02 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -98.92 44.42 1.03 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.051 -1.03 . . . . 0.0 110.651 -179.795 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m -116.76 39.75 3.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.117 -0.989 . . . . 0.0 109.749 179.626 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.38 163.54 21.88 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -179.667 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -89.18 -11.72 42.97 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.281 -1.129 . . . . 0.0 110.842 178.689 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.69 -26.18 19.69 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.729 -1.232 . . . . 0.0 111.087 179.659 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -50.67 -39.58 51.37 Favored 'General case' 0 N--CA 1.516 2.858 0 O-C-N 120.737 -1.227 . . . . 0.0 110.546 -179.577 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -64.13 -54.37 34.83 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.945 179.17 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -60.81 -39.53 89.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.116 178.588 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.2 -38.04 73.09 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.261 -0.899 . . . . 0.0 109.988 179.194 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.423 HG12 ' CE1' ' A' ' 8' ' ' TYR . 78.9 t -56.81 -37.76 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 121.036 -1.04 . . . . 0.0 109.964 179.703 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.5 ttpp -54.87 -41.24 70.6 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.966 -1.084 . . . . 0.0 109.716 179.435 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.64 -32.0 68.66 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.868 . . . . 0.0 110.15 178.963 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -67.66 -52.29 39.74 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.093 -1.004 . . . . 0.0 110.158 179.899 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.2 p90 -100.22 33.12 2.75 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.12 -0.987 . . . . 0.0 111.33 179.622 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -79.49 -36.89 37.97 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.755 -1.216 . . . . 0.0 110.144 179.026 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -112.78 31.41 6.4 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.172 -0.955 . . . . 0.0 110.984 179.833 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.5 t90 -84.33 -38.94 19.75 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.085 -1.01 . . . . 0.0 110.219 179.925 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.446 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -153.72 -65.26 0.15 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.121 -0.987 . . . . 0.0 110.674 179.983 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.4 -164.64 1.51 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.19 -0.944 . . . . 0.0 110.15 -179.736 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -112.58 39.01 2.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.191 -0.943 . . . . 0.0 110.303 179.877 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -151.17 73.73 1.11 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.167 -0.958 . . . . 0.0 110.43 179.874 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.11 70.64 1.37 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.219 -0.926 . . . . 0.0 110.217 -179.945 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.85 34.56 4.75 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.224 -0.922 . . . . 0.0 110.516 179.646 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.4 m -107.28 -53.05 2.67 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.152 -0.967 . . . . 0.0 109.243 179.184 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.04 -21.37 63.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.244 -0.91 . . . . 0.0 111.225 179.203 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.482 HD11 HG22 ' A' ' 50' ' ' ILE . 49.9 mm -77.56 -54.87 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.604 -1.31 . . . . 0.0 109.534 179.603 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.419 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 23.0 t70 -60.61 -40.97 93.8 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.798 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.69 -35.82 73.24 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.175 -0.953 . . . . 0.0 110.333 179.782 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -84.85 -36.04 21.84 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.995 -1.065 . . . . 0.0 110.308 179.717 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.419 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.8 p -74.76 -35.39 62.58 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.046 -1.034 . . . . 0.0 110.559 179.812 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.02 -39.51 12.16 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.046 -1.033 . . . . 0.0 110.295 179.953 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.83 54.65 1.76 Allowed 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.122 -0.986 . . . . 0.0 110.447 179.713 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -92.85 -39.52 11.14 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.154 -0.967 . . . . 0.0 110.086 179.586 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -134.04 77.11 1.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.165 -0.959 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.03 -63.13 1.5 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.118 -0.989 . . . . 0.0 110.234 179.906 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 138.84 109.54 0.87 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.86 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.14 -1.212 . . . . 0.0 110.175 179.889 . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mtt . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.72 144.65 39.79 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.399 1.21 . . . . 0.0 110.217 179.875 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.432 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 16.2 mtmm 55.39 99.52 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.07 -1.019 . . . . 0.0 110.374 -179.859 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.422 ' CD2' ' HG2' ' A' ' 21' ' ' ARG . 63.7 t80 -54.0 159.16 1.86 Allowed 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.083 -1.01 . . . . 0.0 111.049 -179.493 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -141.71 130.91 23.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.887 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.5 t -113.39 92.36 3.97 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.095 -1.003 . . . . 0.0 110.449 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -53.57 -35.69 61.07 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.024 -1.048 . . . . 0.0 110.233 179.482 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.428 ' CE1' HG12 ' A' ' 34' ' ' VAL . 86.0 m-85 -59.75 -35.42 74.54 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.134 -0.979 . . . . 0.0 109.975 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.3 m -93.54 1.08 56.85 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.186 -0.946 . . . . 0.0 112.075 179.971 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.1 38.34 23.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.453 -1.404 . . . . 0.0 110.749 -179.843 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -141.17 168.42 19.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.203 -0.936 . . . . 0.0 110.147 179.908 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.432 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 33.0 t80 -122.84 133.0 54.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.302 -0.874 . . . . 0.0 110.307 -179.739 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.1 mp -89.23 163.85 15.22 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.11 -0.994 . . . . 0.0 109.721 179.591 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.412 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -99.56 -30.81 11.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.081 -1.012 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.412 ' CD2' HG21 ' A' ' 14' ' ' THR . 44.1 m-70 -114.85 136.1 53.46 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.79 -1.194 . . . . 0.0 110.231 -179.858 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -112.92 92.85 4.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.219 -0.926 . . . . 0.0 109.826 179.75 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.85 178.77 1.51 Allowed Pre-proline 0 N--CA 1.494 1.732 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.715 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.62 -29.58 19.54 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 O-C-N 123.377 1.199 . . . . 0.0 111.137 -179.91 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.422 ' O ' ' OG1' ' A' ' 23' ' ' THR . 1.8 t -88.91 -43.56 11.09 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.948 -1.095 . . . . 0.0 109.936 179.538 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.5 t -59.83 -52.65 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.762 179.756 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 31.2 mtp-105 -58.03 -49.9 75.27 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.122 -0.986 . . . . 0.0 109.546 179.784 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -61.54 -40.35 94.35 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.841 178.689 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.422 ' OG1' ' O ' ' A' ' 19' ' ' SER . 65.1 m -54.25 -42.71 70.21 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.105 -0.997 . . . . 0.0 108.639 178.407 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -63.14 -38.65 92.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.606 -0.838 . . . . 0.0 109.075 178.198 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -95.2 53.4 1.52 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.221 -0.924 . . . . 0.0 110.457 -179.702 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.79 40.28 2.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.168 -0.957 . . . . 0.0 109.782 179.618 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.21 147.41 19.19 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 -179.74 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -79.93 -10.36 59.77 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.224 -1.163 . . . . 0.0 111.047 178.864 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -90.54 -19.36 23.86 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.632 -1.293 . . . . 0.0 111.467 179.657 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -48.63 -40.32 27.26 Favored 'General case' 0 N--CA 1.517 2.925 0 O-C-N 120.681 -1.262 . . . . 0.0 110.907 -179.758 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.15 -52.81 57.25 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.743 179.118 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.29 -38.93 88.56 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.235 -0.915 . . . . 0.0 108.987 178.452 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -55.43 -37.79 68.14 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.428 HG12 ' CE1' ' A' ' 8' ' ' TYR . 60.9 t -57.87 -37.49 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.139 -0.976 . . . . 0.0 109.788 179.576 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 27.3 tttt -54.42 -41.11 68.96 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.874 -1.141 . . . . 0.0 109.763 179.38 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.5 -27.95 64.94 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.366 178.961 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -71.35 -53.02 15.56 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.897 -1.127 . . . . 0.0 110.089 179.983 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.85 33.68 2.49 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.151 -0.968 . . . . 0.0 111.256 179.624 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -81.67 -37.25 27.73 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.767 -1.208 . . . . 0.0 110.145 179.027 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -100.06 20.92 13.58 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.195 -0.941 . . . . 0.0 111.212 179.332 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.46 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 15.0 t90 -102.6 -48.62 4.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.837 -1.165 . . . . 0.0 109.951 179.77 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.46 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -124.98 -58.13 1.48 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.24 -0.912 . . . . 0.0 109.997 179.725 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 54.0 38.73 29.51 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.922 -1.111 . . . . 0.0 110.822 179.998 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -145.87 -61.38 0.33 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.169 -0.957 . . . . 0.0 110.156 179.863 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -151.24 74.91 1.16 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.158 -0.964 . . . . 0.0 110.459 179.845 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.25 71.36 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.193 -0.942 . . . . 0.0 110.469 -179.824 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -123.32 32.33 5.69 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.223 -0.923 . . . . 0.0 110.689 179.364 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.02 -48.25 3.94 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.082 -1.011 . . . . 0.0 109.687 179.271 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -21.23 62.33 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.197 -0.94 . . . . 0.0 111.492 179.342 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.424 HD13 ' CE2' ' A' ' 38' ' ' TYR . 50.9 mm -80.85 -40.2 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.666 -1.272 . . . . 0.0 110.001 179.861 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.412 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 2.0 t70 -80.43 -40.98 25.32 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.194 -0.941 . . . . 0.0 109.897 179.791 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -33.27 69.34 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.21 -0.931 . . . . 0.0 110.558 179.751 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.7 m -90.38 -38.32 13.4 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.944 -1.097 . . . . 0.0 110.489 -179.982 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.412 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 33.8 p -69.31 -37.35 77.74 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.087 -1.008 . . . . 0.0 110.379 179.856 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.51 -40.62 63.92 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.043 -1.036 . . . . 0.0 110.015 179.982 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.43 50.54 1.15 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.126 -0.984 . . . . 0.0 110.596 179.606 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -93.15 -39.23 11.15 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.15 -0.969 . . . . 0.0 110.328 179.828 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.79 -59.69 1.96 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.207 -0.933 . . . . 0.0 110.356 -179.859 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -136.67 -59.0 0.73 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.197 -0.94 . . . . 0.0 110.43 -179.848 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 61.31 83.25 0.06 OUTLIER Glycine 0 N--CA 1.495 2.612 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.943 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.7 ttpp . . . . . 0 N--CA 1.494 1.747 0 O-C-N 121.214 -1.168 . . . . 0.0 110.231 -179.983 . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.61 122.84 8.58 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.417 1.219 . . . . 0.0 110.399 179.969 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.424 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 15.8 mmtt -124.19 162.05 24.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.196 -0.94 . . . . 0.0 110.054 -179.956 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 76.0 t80 -114.57 161.89 17.46 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.992 179.689 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -142.78 131.34 22.45 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.251 -0.906 . . . . 0.0 110.223 -179.457 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.7 t -108.08 92.25 3.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.132 -0.98 . . . . 0.0 110.012 179.339 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -51.44 -35.54 39.95 Favored 'General case' 0 N--CA 1.515 2.824 0 O-C-N 121.151 -0.968 . . . . 0.0 110.539 -179.989 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.431 ' CE2' HG12 ' A' ' 34' ' ' VAL . 79.6 m-85 -61.62 -31.04 71.1 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.059 -1.025 . . . . 0.0 110.144 179.068 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.4 m -100.8 -4.21 28.43 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.936 -1.102 . . . . 0.0 112.334 -179.856 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 t70 54.21 38.68 29.73 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.347 -1.471 . . . . 0.0 110.453 -179.614 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -137.03 169.78 17.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.218 -0.926 . . . . 0.0 109.745 179.785 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 13.9 t80 -119.34 139.54 51.8 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.207 -0.933 . . . . 0.0 110.641 -179.549 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mp -104.01 155.83 18.35 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.287 -0.883 . . . . 0.0 109.471 179.396 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.4 t -103.56 -29.43 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.076 -1.015 . . . . 0.0 112.293 -179.122 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -109.62 86.53 2.31 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.778 -1.201 . . . . 0.0 110.481 -179.734 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -73.78 71.08 1.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.24 -0.913 . . . . 0.0 110.169 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.45 179.77 0.73 Allowed Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 109.934 179.965 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -71.7 -31.35 13.32 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.292 1.154 . . . . 0.0 111.067 -179.915 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' OG1' ' A' ' 23' ' ' THR . 58.5 m -85.53 -46.49 10.79 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.943 -1.098 . . . . 0.0 109.832 179.58 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 84.6 t -59.06 -52.26 62.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.089 -1.007 . . . . 0.0 109.719 179.802 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 3.1 mtt180 -56.7 -51.44 68.8 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.097 -1.002 . . . . 0.0 109.696 179.842 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -61.6 -40.49 95.0 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.766 178.816 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' ' 19' ' ' SER . 99.0 m -55.16 -43.43 74.27 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.056 -1.027 . . . . 0.0 108.408 178.273 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.029 178.052 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -97.8 47.53 1.01 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.241 -0.912 . . . . 0.0 110.513 -179.697 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -116.21 40.23 2.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.139 -0.976 . . . . 0.0 109.815 179.493 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.11 150.36 20.16 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -179.705 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -81.14 -10.04 59.71 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.232 -1.157 . . . . 0.0 111.031 178.844 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mttp -90.46 -21.55 21.82 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.7 -1.25 . . . . 0.0 111.408 179.602 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 -48.33 -37.55 16.85 Favored 'General case' 0 N--CA 1.518 2.97 0 O-C-N 120.806 -1.184 . . . . 0.0 110.998 -179.735 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -63.79 -54.44 35.08 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -60.4 -39.47 87.45 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.273 -0.892 . . . . 0.0 108.968 178.748 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -55.68 -37.41 68.29 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.224 -0.923 . . . . 0.0 110.11 179.158 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.431 HG12 ' CE2' ' A' ' 8' ' ' TYR . 53.0 t -55.67 -35.34 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.015 -1.053 . . . . 0.0 110.222 179.74 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 62.8 tttt -53.1 -41.33 64.85 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.876 -1.14 . . . . 0.0 110.025 179.659 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.67 -28.91 66.18 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.296 -0.877 . . . . 0.0 110.382 178.952 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -68.45 -51.75 40.22 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 120.895 -1.128 . . . . 0.0 110.368 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.443 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.1 p90 -100.07 35.55 2.04 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.016 -1.053 . . . . 0.0 111.196 179.753 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -39.23 12.94 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.88 -1.138 . . . . 0.0 109.843 178.72 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -111.65 31.01 6.47 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.297 -0.877 . . . . 0.0 110.639 179.378 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.3 t90 -94.62 -40.26 9.92 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.082 -1.011 . . . . 0.0 110.152 -179.901 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.446 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -148.47 -63.89 0.25 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 179.954 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -146.79 -164.56 2.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.119 -0.988 . . . . 0.0 110.199 -179.908 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -111.39 39.76 2.24 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.137 -0.977 . . . . 0.0 110.143 179.884 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -144.54 74.45 1.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.233 -0.917 . . . . 0.0 110.216 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.44 71.81 1.3 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.194 -0.941 . . . . 0.0 110.355 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -114.7 35.02 4.45 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.22 -0.925 . . . . 0.0 110.493 179.663 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.2 p -108.37 -53.12 2.67 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.084 -1.01 . . . . 0.0 109.419 179.315 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -20.68 63.98 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.154 -0.966 . . . . 0.0 111.35 179.39 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.6 mm -74.82 -44.08 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.557 -1.339 . . . . 0.0 109.685 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.84 -41.46 95.86 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.193 -0.942 . . . . 0.0 109.826 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -59.8 -36.22 76.31 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.262 179.872 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 m -87.65 -36.96 17.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.058 -1.026 . . . . 0.0 110.329 179.743 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -75.31 -40.33 58.62 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.062 -1.024 . . . . 0.0 109.882 179.729 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.99 -34.44 56.09 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.023 -1.048 . . . . 0.0 110.88 179.901 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.72 -35.91 20.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.06 -1.025 . . . . 0.0 110.419 179.865 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -92.14 11.61 24.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.999 -1.063 . . . . 0.0 111.978 179.703 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -131.38 76.28 1.71 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.614 -1.303 . . . . 0.0 110.076 179.797 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -113.27 50.76 0.87 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.167 -0.958 . . . . 0.0 110.226 179.99 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.96 -74.3 1.27 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.949 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttm . . . . . 0 N--CA 1.494 1.739 0 O-C-N 121.154 -1.204 . . . . 0.0 110.267 179.995 . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mtt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.92 162.28 41.45 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 O-C-N 123.416 1.219 . . . . 0.0 110.385 -179.979 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.9 mttm 55.77 169.88 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.311 -0.868 . . . . 0.0 110.78 -179.983 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 5' ' ' TYR . 57.4 t80 -130.51 162.28 29.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.048 -1.033 . . . . 0.0 110.013 -179.683 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 33.4 t80 -135.52 132.65 37.55 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.177 -0.952 . . . . 0.0 110.532 -179.583 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.7 t -110.65 90.09 3.23 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.214 -0.929 . . . . 0.0 109.633 179.248 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -50.06 -34.92 23.17 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.131 -0.981 . . . . 0.0 111.197 -179.603 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.414 ' CD1' HG12 ' A' ' 34' ' ' VAL . 25.2 m-85 -64.17 -32.24 73.74 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.848 179.526 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 43.7 m -95.98 -6.36 39.08 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.971 -1.081 . . . . 0.0 112.041 179.696 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 t70 55.81 39.68 30.71 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.447 -1.408 . . . . 0.0 110.352 -179.456 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -140.24 169.68 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 109.79 179.82 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -120.55 144.56 48.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.148 -0.97 . . . . 0.0 110.563 -179.685 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 mp -102.97 166.42 10.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.16 -0.962 . . . . 0.0 109.771 179.543 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.41 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -104.41 -29.96 10.38 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.103 -0.998 . . . . 0.0 112.285 -179.17 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.41 ' CD2' HG21 ' A' ' 14' ' ' THR . 51.2 m-70 -112.68 124.19 52.0 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.7 -1.25 . . . . 0.0 110.451 -179.577 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -98.69 64.95 1.53 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.107 -0.996 . . . . 0.0 110.408 179.907 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.78 178.36 0.98 Allowed Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.214 -0.929 . . . . 0.0 109.96 179.825 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.07 -35.94 6.44 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.359 1.189 . . . . 0.0 110.736 -179.939 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.415 ' O ' ' OG1' ' A' ' 23' ' ' THR . 3.3 t -76.23 -39.54 54.27 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.063 -1.023 . . . . 0.0 110.011 179.711 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.6 t -58.94 -54.53 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.112 -0.993 . . . . 0.0 109.856 179.923 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -55.37 -50.85 68.63 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.054 -1.029 . . . . 0.0 109.793 179.946 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -62.0 -40.85 97.06 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.797 178.77 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 19' ' ' SER . 86.3 m -56.43 -44.17 80.16 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.082 -1.011 . . . . 0.0 108.318 178.324 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -63.21 -38.29 90.6 Favored 'General case' 0 N--CA 1.503 2.192 0 C-N-CA 119.66 -0.816 . . . . 0.0 108.869 178.11 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.9 t -94.34 55.1 1.95 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.307 -0.871 . . . . 0.0 110.206 -179.988 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -114.85 39.84 2.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 110.005 179.759 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -138.52 152.14 21.89 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -81.22 -11.96 59.27 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.238 -1.154 . . . . 0.0 111.183 179.053 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -90.99 -20.92 21.59 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.694 -1.254 . . . . 0.0 111.456 179.704 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -49.0 -42.39 37.73 Favored 'General case' 0 N--CA 1.518 2.929 0 O-C-N 120.715 -1.24 . . . . 0.0 111.007 -179.627 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 mtmt -62.52 -55.05 31.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.129 -0.982 . . . . 0.0 109.019 179.356 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -38.48 83.03 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.15 178.612 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.08 -39.65 75.39 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.274 -0.891 . . . . 0.0 109.935 179.359 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.414 HG12 ' CD1' ' A' ' 8' ' ' TYR . 96.9 t -62.71 -36.2 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.174 -0.954 . . . . 0.0 109.823 179.476 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.2 ttpp -52.33 -39.86 61.2 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 120.998 -1.064 . . . . 0.0 110.079 179.444 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.64 -32.13 68.77 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.195 178.985 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -66.65 -52.42 45.12 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.86 -1.15 . . . . 0.0 110.144 179.933 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.1 33.59 2.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.087 -1.008 . . . . 0.0 111.297 179.592 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -36.41 39.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.783 -1.198 . . . . 0.0 110.163 179.006 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -111.13 30.05 7.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.16 -0.963 . . . . 0.0 110.969 179.701 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.429 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 26.2 t90 -92.53 -39.79 11.17 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.119 -0.988 . . . . 0.0 110.124 179.888 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.429 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 7.6 tpp -143.65 -59.95 0.4 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.115 -0.991 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -151.99 -170.32 3.61 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.211 -0.93 . . . . 0.0 110.392 -179.803 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -106.29 52.77 0.72 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.1 -1.0 . . . . 0.0 110.157 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -166.36 73.47 0.16 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.187 -0.945 . . . . 0.0 110.775 179.962 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 38' ' ' TYR . . . -146.14 72.07 1.28 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.266 -0.897 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -110.93 36.08 3.28 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.238 -0.914 . . . . 0.0 110.32 179.573 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -110.4 -54.07 2.62 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.151 -0.968 . . . . 0.0 109.617 179.436 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.403 ' O ' ' OG1' ' A' ' 53' ' ' THR . 0.6 OUTLIER -60.87 -21.41 63.25 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.244 -0.91 . . . . 0.0 111.458 179.508 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.421 HG13 ' CE2' ' A' ' 38' ' ' TYR . 46.7 mm -70.5 -40.86 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.569 -1.332 . . . . 0.0 109.672 179.651 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -34.83 79.31 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.147 -0.971 . . . . 0.0 110.474 179.838 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -90.08 -39.36 12.94 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.034 -1.041 . . . . 0.0 110.403 179.895 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 49' ' ' LEU . 85.3 m -64.87 -39.07 92.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.13 -0.981 . . . . 0.0 110.005 179.897 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.7 p -56.93 -38.15 72.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.064 -1.023 . . . . 0.0 110.46 179.964 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.15 -40.4 11.04 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.13 -0.981 . . . . 0.0 110.222 179.849 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.65 52.93 1.39 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 179.74 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -92.74 -44.41 8.55 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.246 -0.909 . . . . 0.0 110.118 179.686 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -117.64 -64.39 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.201 -0.937 . . . . 0.0 110.184 -179.999 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -138.56 78.89 1.7 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.192 179.964 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.0 -76.47 1.34 Allowed Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.987 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.21 -1.171 . . . . 0.0 110.139 -179.93 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 mmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.86 166.61 29.51 Favored 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.403 1.212 . . . . 0.0 110.377 -179.913 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.422 ' HB2' ' CZ ' ' A' ' 12' ' ' TYR . 46.9 mttt -131.66 157.73 42.94 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.228 -0.92 . . . . 0.0 110.197 179.969 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -112.4 161.9 16.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.9 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -131.28 138.28 49.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.165 -0.96 . . . . 0.0 110.401 -179.719 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.5 t -116.83 96.95 5.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.156 -0.965 . . . . 0.0 109.955 179.46 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -51.53 -35.63 41.47 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.014 -1.054 . . . . 0.0 110.658 -179.991 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.43 ' CE2' HG12 ' A' ' 34' ' ' VAL . 81.8 m-85 -63.14 -31.07 72.12 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.132 -0.98 . . . . 0.0 110.202 179.252 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 51.7 m -100.07 -10.14 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.972 -1.08 . . . . 0.0 112.055 -179.939 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t0 56.39 40.76 29.6 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.405 -1.434 . . . . 0.0 110.167 -179.464 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -141.76 172.49 12.61 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.221 -0.924 . . . . 0.0 109.985 179.944 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.422 ' CZ ' ' HB2' ' A' ' 3' ' ' LYS . 5.0 t80 -119.96 135.1 55.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.17 -0.956 . . . . 0.0 110.575 -179.72 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.7 mp -91.48 170.28 10.08 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.234 -0.916 . . . . 0.0 109.687 179.537 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.421 HG21 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -97.58 -31.68 12.19 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.175 -0.953 . . . . 0.0 111.388 -179.717 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.421 ' CD2' HG21 ' A' ' 14' ' ' THR . 39.3 m-70 -116.05 135.86 53.56 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.849 -1.157 . . . . 0.0 110.125 179.989 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.01 95.85 5.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.149 -0.969 . . . . 0.0 109.882 179.822 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.73 177.74 1.68 Allowed Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.905 . . . . 0.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.5 -32.15 16.01 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.398 1.209 . . . . 0.0 110.969 179.824 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.405 ' O ' ' OG1' ' A' ' 23' ' ' THR . 26.8 m -85.11 -40.26 16.97 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.933 -1.105 . . . . 0.0 109.979 179.562 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 92.5 t -63.18 -49.52 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.135 -0.978 . . . . 0.0 109.688 179.793 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.6 mtm-85 -55.93 -52.14 65.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.061 -1.024 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -61.15 -40.28 93.26 Favored 'General case' 0 N--CA 1.509 2.48 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.883 178.811 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.405 ' OG1' ' O ' ' A' ' 19' ' ' SER . 98.9 m -55.49 -43.44 75.61 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.085 -1.009 . . . . 0.0 108.368 178.345 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -62.17 -38.8 90.42 Favored 'General case' 0 N--CA 1.504 2.227 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 177.974 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.5 t -95.83 52.34 1.32 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.218 -0.926 . . . . 0.0 110.373 -179.89 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -120.0 37.36 4.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.094 -1.003 . . . . 0.0 110.256 179.775 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.07 128.53 3.45 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.948 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -54.03 -28.89 41.2 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.168 -1.195 . . . . 0.0 110.423 179.199 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -59.75 -35.39 74.49 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.958 -1.089 . . . . 0.0 110.352 179.906 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.3 t-80 -51.25 -38.98 55.66 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.925 -1.11 . . . . 0.0 110.61 -179.611 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -62.18 -55.42 28.8 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.164 -0.96 . . . . 0.0 109.131 179.381 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -59.36 -39.45 83.32 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.249 -0.907 . . . . 0.0 109.124 178.766 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -56.44 -38.39 71.55 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.317 -0.864 . . . . 0.0 109.97 179.252 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.43 HG12 ' CE2' ' A' ' 8' ' ' TYR . 72.3 t -58.92 -37.11 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.15 -0.969 . . . . 0.0 109.952 179.743 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 31.2 mtmt -53.37 -41.46 65.87 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.969 -1.082 . . . . 0.0 109.863 179.768 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -58.38 -32.37 68.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.311 -0.868 . . . . 0.0 110.152 178.891 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -63.48 -51.31 66.13 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.027 -1.046 . . . . 0.0 110.151 179.935 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 47.7 p90 -100.66 36.27 1.96 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.09 -1.006 . . . . 0.0 111.151 179.62 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.15 -37.79 14.78 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.882 -1.137 . . . . 0.0 110.131 178.887 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.96 27.96 9.07 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.194 -0.941 . . . . 0.0 111.014 179.568 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.44 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 23.0 t90 -92.81 -40.49 10.62 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.989 -1.069 . . . . 0.0 110.198 179.921 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.44 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -149.18 -63.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.097 -1.002 . . . . 0.0 110.502 179.954 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.54 2.18 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.207 -0.933 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -109.8 39.42 2.13 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -0.98 . . . . 0.0 110.259 179.787 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -148.45 75.69 1.33 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.157 -0.964 . . . . 0.0 110.299 179.885 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.9 74.67 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.294 -0.879 . . . . 0.0 110.251 -179.836 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.91 35.01 3.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.173 -0.955 . . . . 0.0 110.46 179.611 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.3 p -109.16 -54.75 2.5 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.084 -1.01 . . . . 0.0 109.189 179.152 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -20.51 65.0 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.283 -0.885 . . . . 0.0 111.175 179.154 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.7 mm -75.24 -40.22 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.67 -1.269 . . . . 0.0 109.837 179.778 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -40.42 73.33 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.175 -0.953 . . . . 0.0 109.957 179.942 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -58.2 -35.66 71.97 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.252 -0.905 . . . . 0.0 110.488 179.967 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.0 m -90.7 -48.08 7.27 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.091 -1.006 . . . . 0.0 110.155 179.848 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 64.4 p -57.38 -34.73 69.16 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.206 -0.934 . . . . 0.0 110.553 179.91 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.36 -40.13 12.27 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.035 -1.041 . . . . 0.0 110.107 179.734 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.13 48.36 1.05 Allowed 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.13 -0.981 . . . . 0.0 110.629 179.617 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.63 -42.86 9.41 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.074 -1.016 . . . . 0.0 110.258 179.724 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -131.86 74.8 1.61 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.177 -0.952 . . . . 0.0 110.499 179.946 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -113.82 -55.92 2.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.134 -0.979 . . . . 0.0 110.214 179.794 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 116.62 -56.01 0.54 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.898 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.5 mttp . . . . . 0 N--CA 1.494 1.758 0 O-C-N 121.219 -1.165 . . . . 0.0 110.181 179.987 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mtm . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.59 151.83 53.09 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.474 1.249 . . . . 0.0 110.368 179.992 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -125.49 155.41 40.57 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.234 -0.916 . . . . 0.0 110.037 -179.884 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -113.31 161.77 16.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.065 -1.022 . . . . 0.0 109.998 179.93 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -137.76 133.66 34.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.272 -0.892 . . . . 0.0 110.278 -179.687 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 t -114.45 98.18 6.75 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.201 -0.937 . . . . 0.0 109.718 179.382 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -56.32 -36.96 69.31 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.101 -0.999 . . . . 0.0 110.758 -179.434 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.429 ' CD1' HG12 ' A' ' 34' ' ' VAL . 27.8 m-85 -61.93 -32.66 73.08 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.953 -1.092 . . . . 0.0 110.169 179.555 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.8 m -93.31 -6.15 48.07 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.95 -1.094 . . . . 0.0 111.897 179.456 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.71 39.48 31.34 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.443 -1.41 . . . . 0.0 110.437 -179.688 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -142.12 168.08 20.59 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.253 -0.905 . . . . 0.0 109.895 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -118.23 139.99 50.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.571 -179.706 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -97.62 166.3 11.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.24 -0.912 . . . . 0.0 109.657 179.565 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.4 t -100.91 -30.63 11.55 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.128 -0.983 . . . . 0.0 111.881 -179.452 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -118.11 134.98 54.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.799 -1.188 . . . . 0.0 110.226 -179.871 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -112.3 96.73 6.18 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.198 -0.939 . . . . 0.0 109.818 179.685 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -142.52 177.9 1.69 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 -179.568 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -69.87 -29.95 22.54 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.416 1.219 . . . . 0.0 111.039 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' A' ' 23' ' ' THR . 7.0 t -88.72 -44.04 10.85 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.927 -1.108 . . . . 0.0 109.867 179.396 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.2 -48.96 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.562 0 O-C-N 121.196 -0.94 . . . . 0.0 109.468 179.574 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -59.15 -50.65 73.22 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 109.25 179.541 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -61.7 -40.37 94.79 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.2 -0.937 . . . . 0.0 108.788 178.7 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' A' ' 19' ' ' SER . 88.2 m -54.66 -43.57 72.52 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.042 -1.036 . . . . 0.0 108.455 178.292 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -63.38 -40.36 97.04 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.949 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -94.36 55.7 2.03 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.29 -0.881 . . . . 0.0 110.097 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.95 37.5 3.63 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.18 -0.95 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.08 125.62 2.14 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -179.952 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ttp85 -54.28 -28.34 41.32 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.207 -1.172 . . . . 0.0 110.436 179.157 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -61.22 -31.57 71.35 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.949 -1.094 . . . . 0.0 110.626 179.882 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -49.35 -38.82 29.54 Favored 'General case' 0 N--CA 1.515 2.782 0 O-C-N 120.903 -1.123 . . . . 0.0 110.937 -179.503 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -63.73 -55.2 25.02 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.101 -1.0 . . . . 0.0 109.039 179.339 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -60.33 -38.99 85.46 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.136 178.682 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -57.16 -36.81 71.22 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.215 -0.928 . . . . 0.0 110.222 179.27 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.429 HG12 ' CD1' ' A' ' 8' ' ' TYR . 97.3 t -58.04 -38.69 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.069 -1.019 . . . . 0.0 109.908 179.898 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 11.3 mttt -58.59 -42.09 87.3 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.009 -1.057 . . . . 0.0 109.454 179.227 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -59.48 -31.15 69.08 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.035 178.805 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.411 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 51.2 t80 -67.36 -51.54 50.92 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.012 -1.055 . . . . 0.0 110.346 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.44 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 42.4 p90 -99.25 29.84 3.76 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.036 -1.04 . . . . 0.0 111.695 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -78.37 -39.75 38.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.652 -1.28 . . . . 0.0 109.732 178.666 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -115.36 36.87 3.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 179.41 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.9 t90 -92.26 -38.5 12.05 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.175 -0.953 . . . . 0.0 110.19 -179.771 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -147.11 -65.51 0.27 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.16 -0.962 . . . . 0.0 110.347 179.89 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.89 -163.11 1.66 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.205 -0.934 . . . . 0.0 110.152 -179.878 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -103.66 -177.5 3.39 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.104 -0.998 . . . . 0.0 110.073 179.791 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 53.28 74.54 0.3 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.025 -1.047 . . . . 0.0 110.608 -179.743 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.41 70.15 1.42 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.247 -0.908 . . . . 0.0 110.166 -179.967 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.64 33.61 5.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.254 -0.904 . . . . 0.0 110.629 179.595 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.96 -53.04 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.022 -1.049 . . . . 0.0 109.009 179.032 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.8 -20.54 65.12 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.331 -0.855 . . . . 0.0 111.181 178.943 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.43 HG13 ' CE1' ' A' ' 38' ' ' TYR . 50.9 mm -81.53 -55.52 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 120.724 -1.235 . . . . 0.0 109.803 179.714 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.427 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 4.1 t0 -54.64 -38.97 67.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.552 -179.833 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.93 -36.69 82.12 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 179.975 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.0 m -91.4 -42.73 10.16 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.026 -1.046 . . . . 0.0 110.379 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.427 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.8 p -59.94 -40.16 88.02 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.104 -0.998 . . . . 0.0 109.994 179.999 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.57 -37.39 78.34 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.147 -0.971 . . . . 0.0 110.245 179.783 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.81 -32.64 65.68 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.136 -0.978 . . . . 0.0 110.76 179.867 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -88.85 -39.23 13.99 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.948 -1.095 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.18 -46.32 77.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.151 -0.968 . . . . 0.0 109.963 179.923 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -142.72 77.71 1.58 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.895 . . . . 0.0 110.19 179.922 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.48 -60.19 6.93 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.908 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt . . . . . 0 N--CA 1.494 1.734 0 O-C-N 121.219 -1.165 . . . . 0.0 110.235 -179.965 . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.409 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 22.4 mttt . . . . . 0 N--CA 1.504 2.267 0 CA-C-O 121.145 0.497 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.57 ' HD2' HD13 ' A' ' 13' ' ' LEU . 62.4 t80 -112.71 157.71 20.95 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.99 -1.069 . . . . 0.0 109.979 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -136.36 140.22 43.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.187 -0.946 . . . . 0.0 110.471 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.7 t -110.45 97.41 6.86 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.134 -0.979 . . . . 0.0 110.136 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -52.36 -35.87 52.32 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.036 -1.04 . . . . 0.0 110.534 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.83 ' CD1' HG13 ' A' ' 34' ' ' VAL . 93.2 m-85 -62.67 -33.06 74.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.135 -0.978 . . . . 0.0 110.243 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.3 m -100.11 -3.05 32.65 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.028 -1.045 . . . . 0.0 112.282 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 53.24 38.3 27.3 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.409 -1.432 . . . . 0.0 110.75 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 t -129.32 173.53 10.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.158 -0.964 . . . . 0.0 110.03 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.409 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -123.69 108.68 12.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 110.099 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.57 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.7 mp -69.57 157.08 37.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.147 -0.971 . . . . 0.0 109.905 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.408 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.7 t -101.95 -31.15 10.82 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.21 -0.931 . . . . 0.0 111.875 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.534 ' O ' HG11 ' A' ' 20' ' ' VAL . 32.6 m170 -112.03 98.47 7.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.744 -1.223 . . . . 0.0 110.33 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.36 71.06 9.42 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.232 -0.918 . . . . 0.0 110.429 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -110.33 179.87 0.76 Allowed Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.085 -1.009 . . . . 0.0 109.908 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 45.3 Cg_endo -72.81 -30.13 11.76 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.303 1.159 . . . . 0.0 111.421 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -89.84 -40.88 12.15 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.929 -1.107 . . . . 0.0 110.088 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.534 HG11 ' O ' ' A' ' 15' ' ' HIS . 77.8 t -58.67 -50.52 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.123 -0.986 . . . . 0.0 109.759 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -57.56 -51.58 68.88 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.098 -1.001 . . . . 0.0 109.628 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -62.1 -41.09 97.86 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.828 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -54.83 -42.97 72.56 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.137 -0.977 . . . . 0.0 108.552 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.37 -36.12 81.27 Favored 'General case' 0 N--CA 1.503 2.215 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.161 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -99.4 44.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.121 -0.987 . . . . 0.0 110.573 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.55 38.19 3.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.106 -0.996 . . . . 0.0 110.137 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.1 127.28 3.06 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -54.41 -28.29 42.72 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.209 -1.171 . . . . 0.0 110.338 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -60.66 -32.18 71.38 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.994 -1.066 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.541 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.0 t-80 -49.8 -37.14 28.88 Favored 'General case' 0 N--CA 1.518 2.939 0 O-C-N 120.884 -1.135 . . . . 0.0 110.914 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -61.83 -55.62 27.94 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.11 -0.994 . . . . 0.0 109.23 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.63 -38.83 82.43 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.189 -0.944 . . . . 0.0 109.193 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -55.95 -37.27 68.77 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.153 -0.967 . . . . 0.0 110.13 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.83 HG13 ' CD1' ' A' ' 8' ' ' TYR . 75.8 t -56.15 -35.26 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 121.021 -1.049 . . . . 0.0 110.186 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 35.7 tttt -53.38 -41.51 65.98 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.875 -1.14 . . . . 0.0 109.93 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.4 -29.32 65.96 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -70.92 -52.26 21.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.876 -1.14 . . . . 0.0 110.321 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.9 p90 -99.61 33.79 2.41 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.013 -1.055 . . . . 0.0 111.406 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -79.86 -38.15 33.4 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.754 -1.216 . . . . 0.0 110.171 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -116.5 26.36 9.94 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.244 -0.91 . . . . 0.0 111.372 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.63 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 13.0 t90 -56.09 -43.14 77.75 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.873 -1.142 . . . . 0.0 110.218 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.63 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 19.8 ptp -152.75 38.59 0.53 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.156 -0.965 . . . . 0.0 110.74 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 51.31 39.74 24.73 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.02 -1.05 . . . . 0.0 110.965 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -144.43 -165.63 2.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.155 -0.966 . . . . 0.0 110.304 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -117.29 123.98 47.88 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.221 -0.924 . . . . 0.0 110.253 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.404 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -129.91 79.04 1.88 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.418 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 4.1 tt0 -109.34 36.33 2.96 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.11 -0.994 . . . . 0.0 110.463 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.4 t -114.65 -54.98 2.53 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.124 -0.985 . . . . 0.0 109.793 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -22.46 60.74 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 111.479 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.582 HD12 HG11 ' A' ' 34' ' ' VAL . 42.3 mm -65.15 -51.38 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 O-C-N 120.648 -1.282 . . . . 0.0 109.367 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -39.27 72.17 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.104 -0.997 . . . . 0.0 110.406 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -62.98 -36.01 82.09 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.211 -0.93 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.0 m . . . . . 0 N--CA 1.505 2.304 0 O-C-N 121.069 -1.019 . . . . 0.0 110.16 179.854 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.505 2.287 0 CA-C-O 121.066 0.46 . . . . 0.0 110.754 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 52.7 t80 -104.64 156.43 17.98 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.998 -1.064 . . . . 0.0 110.038 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -127.46 137.41 52.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.149 -0.969 . . . . 0.0 110.412 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.35 97.98 6.65 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -54.77 -36.36 64.79 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.056 -1.027 . . . . 0.0 110.284 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.806 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.3 m-85 -60.26 -32.84 71.55 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.029 -1.045 . . . . 0.0 110.111 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HB3' HG22 ' A' ' 11' ' ' THR . 35.9 m -95.79 -1.41 49.75 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.037 -1.04 . . . . 0.0 112.033 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t0 52.39 39.02 26.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.428 -1.42 . . . . 0.0 110.574 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.4 t -146.4 171.86 14.38 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.203 -0.936 . . . . 0.0 110.098 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.2 OUTLIER -120.44 122.61 41.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.15 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -71.34 170.72 12.55 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.174 -0.954 . . . . 0.0 109.826 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.453 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.3 t -100.22 -29.89 12.21 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.296 -0.877 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.656 ' HB2' HG11 ' A' ' 20' ' ' VAL . 39.4 m-70 -113.25 147.66 37.1 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.696 -1.252 . . . . 0.0 110.404 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -123.62 94.58 4.28 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.28 -0.888 . . . . 0.0 109.9 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.12 177.67 1.72 Allowed Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.258 -0.901 . . . . 0.0 110.212 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.4 Cg_endo -70.97 -31.94 14.34 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 O-C-N 123.435 1.229 . . . . 0.0 110.933 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -89.28 -39.62 13.36 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.014 -1.054 . . . . 0.0 110.073 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.43 -46.54 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.067 -1.021 . . . . 0.0 109.692 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 15.3 mtp180 -60.55 -49.46 77.47 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.084 -1.01 . . . . 0.0 109.574 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttt -62.28 -41.15 98.24 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.891 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.2 m -54.58 -42.28 70.87 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.087 -1.008 . . . . 0.0 108.442 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.35 -35.26 79.79 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.394 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -100.18 43.54 1.05 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.123 -0.985 . . . . 0.0 110.56 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -114.93 40.39 2.64 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.09 -1.006 . . . . 0.0 109.824 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -131.38 157.04 22.13 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 ttm-85 -85.51 -10.13 56.45 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.254 -1.145 . . . . 0.0 111.026 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -90.53 -26.01 19.95 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.691 -1.255 . . . . 0.0 111.11 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.0 t-80 -49.76 -38.88 35.74 Favored 'General case' 0 N--CA 1.517 2.916 0 O-C-N 120.814 -1.179 . . . . 0.0 110.574 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -64.58 -53.72 43.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.816 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.09 -39.97 91.94 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.196 -0.94 . . . . 0.0 108.999 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -56.53 -37.88 71.08 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.205 -0.935 . . . . 0.0 110.031 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HD12 ' A' ' 50' ' ' ILE . 93.5 t -57.66 -33.73 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.125 -0.984 . . . . 0.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.0 tttt -52.24 -42.26 63.45 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.87 -1.144 . . . . 0.0 109.849 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.08 -29.53 63.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.336 -0.852 . . . . 0.0 110.375 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -69.38 -52.02 31.08 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.942 -1.099 . . . . 0.0 110.319 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.7 p90 -99.72 35.0 2.1 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.077 -1.014 . . . . 0.0 111.382 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -88.11 -38.34 15.47 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.807 -1.183 . . . . 0.0 109.884 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -112.91 31.58 6.3 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 110.765 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -92.85 -41.7 9.93 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.142 -0.974 . . . . 0.0 110.026 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.445 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -154.95 -65.76 0.13 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.14 -0.975 . . . . 0.0 110.599 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -126.57 -171.55 2.43 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.965 . . . . 0.0 110.005 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.25 38.81 3.44 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.1 -1.0 . . . . 0.0 110.342 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -152.96 75.23 1.08 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.237 -0.914 . . . . 0.0 110.484 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.55 75.43 1.54 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.199 -0.938 . . . . 0.0 110.224 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -111.36 35.86 3.44 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.095 -1.003 . . . . 0.0 110.435 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.54 -55.47 2.5 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.201 -0.937 . . . . 0.0 109.24 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.98 64.51 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.307 -0.871 . . . . 0.0 111.189 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.815 HD12 HG11 ' A' ' 34' ' ' VAL . 47.8 mm -71.6 -40.27 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.62 -1.3 . . . . 0.0 109.618 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -72.76 -39.83 66.5 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.128 -0.983 . . . . 0.0 110.013 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -57.02 -36.22 70.18 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.179 -0.951 . . . . 0.0 110.63 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 90.0 m . . . . . 0 N--CA 1.504 2.25 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.921 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mttp . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CE1' ' NH2' ' A' ' 21' ' ' ARG . 43.5 t80 -114.36 156.36 24.58 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.244 -0.91 . . . . 0.0 110.01 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -135.43 136.79 41.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.399 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -112.27 95.39 5.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.209 -0.932 . . . . 0.0 110.222 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.94 -36.16 59.55 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 121.026 -1.046 . . . . 0.0 110.383 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.69 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.1 m-85 -60.45 -32.18 71.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.149 -0.97 . . . . 0.0 110.067 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -97.66 -1.54 43.41 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.064 -1.023 . . . . 0.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.92 38.51 27.16 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.377 -1.452 . . . . 0.0 110.567 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -139.5 173.07 11.92 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.162 -0.961 . . . . 0.0 109.964 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.96 119.53 30.69 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.279 -0.888 . . . . 0.0 110.254 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.4 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -78.1 163.98 25.39 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.11 -0.994 . . . . 0.0 109.383 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.508 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -101.05 -21.79 14.91 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.132 -0.98 . . . . 0.0 112.166 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.563 ' HB2' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -120.53 139.6 52.67 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.628 -1.295 . . . . 0.0 110.145 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -120.6 93.19 3.96 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.253 -0.904 . . . . 0.0 109.78 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.404 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -139.51 178.39 1.65 Allowed Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.321 -0.862 . . . . 0.0 109.993 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.1 Cg_endo -70.62 -26.82 23.09 Favored 'Trans proline' 0 C--N 1.315 -1.196 0 O-C-N 123.351 1.185 . . . . 0.0 111.308 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.08 -40.71 9.92 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.893 -1.129 . . . . 0.0 110.16 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 15' ' ' HIS . 83.9 t -60.12 -48.39 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.031 -1.043 . . . . 0.0 109.884 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.421 ' NH2' ' CE1' ' A' ' 4' ' ' PHE . 19.6 mtp180 -56.99 -51.69 68.22 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.132 -0.98 . . . . 0.0 109.86 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -60.18 -40.55 90.38 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.179 -0.95 . . . . 0.0 109.048 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 42.1 m -54.69 -42.92 72.03 Favored 'General case' 0 N--CA 1.513 2.675 0 O-C-N 121.035 -1.041 . . . . 0.0 108.369 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -63.73 -38.61 91.76 Favored 'General case' 0 N--CA 1.502 2.175 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.004 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.02 51.93 1.27 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.298 -0.876 . . . . 0.0 110.488 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 37.69 3.82 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.06 -1.025 . . . . 0.0 110.327 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.68 122.8 1.75 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -50.87 -30.26 14.09 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.118 -1.225 . . . . 0.0 110.847 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -33.16 69.6 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.095 -1.003 . . . . 0.0 110.503 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.06 -38.28 37.37 Favored 'General case' 0 N--CA 1.517 2.887 0 O-C-N 121.016 -1.053 . . . . 0.0 110.694 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -62.55 -53.17 58.71 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.161 -0.962 . . . . 0.0 108.972 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -60.61 -39.66 89.01 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.221 -0.924 . . . . 0.0 109.0 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.13 -38.43 68.21 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.207 -0.933 . . . . 0.0 110.099 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD12 ' A' ' 50' ' ' ILE . 74.6 t -59.27 -37.9 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 109.894 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 1.5 tppp? -56.99 -41.79 79.06 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.973 -1.08 . . . . 0.0 109.509 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.27 -29.81 67.84 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.251 -0.905 . . . . 0.0 110.101 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -68.54 -52.53 30.97 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.957 -1.089 . . . . 0.0 110.28 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.667 ' HE1' HG12 ' A' ' 34' ' ' VAL . 38.1 p90 -98.53 24.82 6.97 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.085 -1.01 . . . . 0.0 111.82 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -65.34 -41.23 94.11 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 120.626 -1.296 . . . . 0.0 109.745 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 mtmt -122.63 26.3 8.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.35 -0.844 . . . . 0.0 111.164 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.0 t90 -64.4 -40.6 96.11 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.888 -1.133 . . . . 0.0 110.219 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.449 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 mtm -156.29 -56.53 0.09 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.138 -0.976 . . . . 0.0 110.845 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -126.08 -171.84 2.48 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.138 -0.976 . . . . 0.0 110.532 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -34.19 11.25 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.158 -0.964 . . . . 0.0 111.015 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -93.32 96.17 9.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.927 -1.108 . . . . 0.0 110.189 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -141.48 71.21 1.35 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -121.18 34.14 5.31 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.21 -0.931 . . . . 0.0 110.635 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -106.76 -51.48 2.93 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.125 -0.984 . . . . 0.0 109.558 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -21.14 62.73 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.215 -0.928 . . . . 0.0 111.499 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.794 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.85 -56.3 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 O-C-N 120.665 -1.272 . . . . 0.0 109.77 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.34 -36.71 71.51 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -73.01 -34.04 66.13 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.647 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.6 m . . . . . 0 N--CA 1.505 2.317 0 O-C-N 120.939 -1.101 . . . . 0.0 110.163 179.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 35.0 mmtm . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.689 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.9 t80 -116.26 161.95 18.23 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -132.72 136.15 46.21 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.237 -0.915 . . . . 0.0 110.212 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.39 97.24 6.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.199 -0.938 . . . . 0.0 109.905 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -51.39 -35.57 39.47 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.121 -0.987 . . . . 0.0 110.554 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.534 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.3 m-85 -62.7 -30.8 71.68 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.145 -0.972 . . . . 0.0 110.249 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.3 m -100.02 -8.98 23.2 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.952 -1.093 . . . . 0.0 112.118 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.95 42.44 31.06 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.391 -1.443 . . . . 0.0 110.087 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -145.35 172.43 13.17 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.289 -0.882 . . . . 0.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.457 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 3.5 t80 -118.29 129.49 55.49 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.255 -0.903 . . . . 0.0 110.305 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.689 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.5 mp -85.9 170.2 12.58 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.173 -0.955 . . . . 0.0 109.861 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 3' ' ' LYS . 15.0 t -97.26 -21.96 16.96 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.198 -0.939 . . . . 0.0 111.696 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.792 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.2 m170 -122.16 147.29 46.34 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.619 -1.301 . . . . 0.0 110.097 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -127.08 93.54 3.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.208 -0.933 . . . . 0.0 109.81 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.406 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -148.19 179.1 1.25 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.284 -0.885 . . . . 0.0 110.17 -179.643 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -71.03 -32.09 13.9 Favored 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.326 1.171 . . . . 0.0 110.811 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 -39.72 17.1 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.975 -1.078 . . . . 0.0 109.956 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.792 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.5 t -64.9 -47.12 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 O-C-N 121.11 -0.993 . . . . 0.0 109.678 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.451 ' NH1' ' CD2' ' A' ' 4' ' ' PHE . 11.7 mtp180 -57.61 -51.96 67.39 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.072 -1.017 . . . . 0.0 109.588 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -60.77 -40.36 92.23 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.184 -0.948 . . . . 0.0 108.82 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -55.18 -43.38 74.3 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.141 -0.975 . . . . 0.0 108.546 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.448 ' ND1' HD21 ' A' ' 13' ' ' LEU . 70.8 t60 -61.69 -37.29 83.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.426 -0.796 . . . . 0.0 109.061 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.25 50.06 1.07 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.187 -0.946 . . . . 0.0 110.369 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.71 37.63 3.88 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.051 -1.031 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.68 128.44 3.35 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.2 tpp85 -54.47 -28.52 45.15 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.141 -1.211 . . . . 0.0 110.413 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -59.5 -35.77 74.79 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.977 -1.077 . . . . 0.0 110.355 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.448 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.78 -46.09 64.03 Favored 'General case' 0 N--CA 1.514 2.725 0 O-C-N 120.931 -1.106 . . . . 0.0 110.489 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -54.57 45.59 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.086 -1.009 . . . . 0.0 109.427 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -60.09 -39.47 86.23 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.186 -0.946 . . . . 0.0 109.073 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -56.85 -38.67 73.0 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.948 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.597 HG12 ' HE2' ' A' ' 38' ' ' TYR . 65.9 t -59.06 -38.21 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.554 0 O-C-N 121.139 -0.976 . . . . 0.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 29.3 ttmt -54.97 -40.58 70.16 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.949 -1.095 . . . . 0.0 109.832 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -58.11 -30.16 66.06 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.304 -0.873 . . . . 0.0 110.229 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.24 -53.51 24.15 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.931 -1.106 . . . . 0.0 110.177 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.822 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 39.2 p90 -98.14 22.79 9.01 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.137 -0.977 . . . . 0.0 111.702 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.78 -38.4 90.47 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.593 -1.317 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -113.89 33.28 5.3 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.157 -0.964 . . . . 0.0 110.742 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.478 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 24.5 t90 -92.16 -40.51 10.97 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.19 -0.944 . . . . 0.0 110.151 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.478 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 3.0 ttm -151.78 -62.98 0.17 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.17 -0.956 . . . . 0.0 110.664 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -122.24 -172.9 2.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.0 110.524 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -98.32 -37.35 9.68 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.225 -0.922 . . . . 0.0 110.783 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -105.47 92.81 4.35 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.092 -1.005 . . . . 0.0 110.219 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.822 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -128.52 74.85 1.59 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -0.919 . . . . 0.0 110.13 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.16 35.54 3.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.099 -1.001 . . . . 0.0 110.492 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.0 t -110.5 -54.64 2.56 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.096 -1.002 . . . . 0.0 109.395 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -20.7 64.34 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.25 -0.906 . . . . 0.0 111.393 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.545 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -72.33 -44.91 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 120.681 -1.262 . . . . 0.0 109.788 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -62.79 -48.59 78.48 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.168 -0.957 . . . . 0.0 109.887 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -56.52 -33.48 66.08 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.143 -0.973 . . . . 0.0 110.632 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.3 m . . . . . 0 N--CA 1.503 2.204 0 O-C-N 120.945 -1.097 . . . . 0.0 110.351 179.869 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.4 mttt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.8 t80 -110.4 161.65 15.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.103 -0.998 . . . . 0.0 110.522 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD2' ' A' ' 4' ' ' PHE . 34.9 t80 -133.7 134.06 42.62 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.252 -0.905 . . . . 0.0 110.115 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.9 t -113.53 96.39 5.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -0.975 . . . . 0.0 110.177 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -53.71 -36.34 62.13 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.388 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.6 m-85 -60.74 -32.4 71.67 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.091 -1.006 . . . . 0.0 110.156 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' HG22 ' A' ' 11' ' ' THR . 33.5 m -96.99 -5.94 36.62 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.076 -1.015 . . . . 0.0 112.116 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 54.75 39.98 31.67 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.349 -1.47 . . . . 0.0 110.23 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.409 HG22 ' HB3' ' A' ' 9' ' ' CYS . 9.1 t -143.42 172.24 13.05 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.236 -0.915 . . . . 0.0 109.918 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -117.34 138.82 51.53 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.271 -0.893 . . . . 0.0 110.469 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.0 mp -97.68 168.42 10.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.222 -0.924 . . . . 0.0 109.769 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.515 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -99.38 -29.07 12.98 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.217 -0.927 . . . . 0.0 111.73 -179.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.71 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.6 m-70 -112.06 148.42 33.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.774 -1.204 . . . . 0.0 110.431 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -126.92 93.93 3.89 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.331 -0.856 . . . . 0.0 109.761 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -150.82 178.52 1.49 Allowed Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.272 -0.893 . . . . 0.0 110.305 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.07 -33.3 11.94 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.354 1.186 . . . . 0.0 110.735 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.7 t -83.16 -38.59 22.15 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.011 -1.056 . . . . 0.0 110.033 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.71 HG11 ' HB2' ' A' ' 15' ' ' HIS . 62.2 t -64.1 -47.38 90.43 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -57.97 -50.07 74.62 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.097 -1.002 . . . . 0.0 109.53 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.12 -40.99 97.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.214 -0.929 . . . . 0.0 108.655 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -55.48 -43.84 75.92 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.159 -0.963 . . . . 0.0 108.487 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -62.59 -39.49 93.88 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.353 -0.842 . . . . 0.0 108.863 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.5 t -92.42 56.0 2.65 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.278 -0.889 . . . . 0.0 110.335 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -118.5 37.42 4.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.127 -0.983 . . . . 0.0 110.414 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.15 128.27 3.23 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -54.54 -28.18 43.7 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.153 -1.204 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.941 -1.1 . . . . 0.0 110.522 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.454 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.1 t-80 -51.47 -40.66 59.92 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.951 -1.093 . . . . 0.0 110.523 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.2 tttt -62.75 -55.61 25.03 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.196 -0.94 . . . . 0.0 109.064 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -59.34 -38.85 81.38 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.2 -0.938 . . . . 0.0 109.189 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.62 -38.23 71.81 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.8 HG11 HD12 ' A' ' 50' ' ' ILE . 79.5 t -64.46 -39.57 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 O-C-N 121.134 -0.978 . . . . 0.0 109.641 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.3 ttpt -58.38 -42.79 87.86 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.069 -1.019 . . . . 0.0 109.348 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.02 -30.2 67.84 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.529 -0.869 . . . . 0.0 110.283 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -70.41 -51.82 26.81 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.901 -1.125 . . . . 0.0 110.322 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.721 ' HE1' HG12 ' A' ' 34' ' ' VAL . 40.3 p90 -100.03 34.54 2.28 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.13 -0.981 . . . . 0.0 111.295 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -78.3 -39.63 39.2 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.814 -1.179 . . . . 0.0 110.0 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tttm -117.82 22.69 12.15 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.243 -0.91 . . . . 0.0 111.53 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 13.1 t90 -57.61 -55.29 36.75 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.796 -1.19 . . . . 0.0 110.151 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.457 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 13.2 mtt -149.1 -63.1 0.23 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -122.79 -171.95 2.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.161 -0.962 . . . . 0.0 110.06 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -110.76 39.72 2.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.227 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -145.55 75.02 1.41 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.917 . . . . 0.0 110.174 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.46 71.73 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.239 -0.913 . . . . 0.0 110.343 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.76 34.71 5.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.254 -0.904 . . . . 0.0 110.574 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 7.2 p -108.12 -52.57 2.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.056 -1.027 . . . . 0.0 109.418 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.408 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -60.92 -21.12 63.08 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.195 -0.941 . . . . 0.0 111.418 179.376 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.8 HD12 HG11 ' A' ' 34' ' ' VAL . 49.5 mm -76.12 -52.22 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.659 -1.276 . . . . 0.0 109.597 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -58.45 -39.39 79.72 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.2 -0.937 . . . . 0.0 110.195 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -55.88 -36.34 67.49 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.076 -1.015 . . . . 0.0 110.625 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.504 2.272 0 O-C-N 121.08 -1.013 . . . . 0.0 110.172 179.871 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.5 mttt . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 78.2 t80 -115.65 162.06 17.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.112 -0.993 . . . . 0.0 110.089 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -136.18 132.83 36.47 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.202 -0.936 . . . . 0.0 110.187 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.1 t -112.44 94.1 4.76 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.085 -1.009 . . . . 0.0 110.051 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -52.06 -35.98 49.13 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.074 -1.016 . . . . 0.0 110.518 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.765 ' CD1' HG13 ' A' ' 34' ' ' VAL . 83.5 m-85 -61.07 -32.8 72.44 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.18 -0.95 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.5 m -97.47 -4.08 38.76 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.001 -1.062 . . . . 0.0 112.261 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 53.54 38.99 29.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.446 -1.409 . . . . 0.0 110.479 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -140.68 170.33 15.98 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.904 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.11 137.08 53.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -95.12 163.98 13.06 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.465 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.41 -31.65 11.2 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.041 -1.037 . . . . 0.0 111.724 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.5 m-70 -114.61 132.96 56.18 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.718 -1.239 . . . . 0.0 110.194 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.84 95.94 5.69 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.257 -0.902 . . . . 0.0 109.809 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -141.58 179.37 1.24 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.2 -0.937 . . . . 0.0 109.966 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.17 -28.04 19.25 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.314 1.165 . . . . 0.0 111.176 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.88 -41.94 10.89 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.901 -1.125 . . . . 0.0 109.974 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.436 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.1 t -60.92 -50.96 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.524 0 O-C-N 121.178 -0.951 . . . . 0.0 109.66 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -57.09 -51.11 70.61 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.125 -0.984 . . . . 0.0 109.607 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -61.33 -40.57 94.7 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.797 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 92.5 m -54.77 -43.56 72.87 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.121 -0.987 . . . . 0.0 108.443 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -63.47 -39.72 95.21 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.08 52.12 1.27 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -117.83 37.63 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.154 -0.966 . . . . 0.0 110.347 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.67 127.28 2.68 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.944 -1.263 . . . . 0.0 109.944 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -54.37 -28.69 44.87 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.033 -1.275 . . . . 0.0 110.169 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -58.46 -33.87 70.23 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 120.99 -1.068 . . . . 0.0 110.464 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -50.47 -38.71 45.35 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.925 -1.109 . . . . 0.0 110.75 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -63.16 -54.28 40.08 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.104 -0.998 . . . . 0.0 108.945 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -60.13 -38.98 84.69 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.11 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.11 -38.33 70.61 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.24 -0.913 . . . . 0.0 110.117 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.765 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.5 t -59.14 -37.32 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.062 -1.024 . . . . 0.0 109.879 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.3 ttpp -53.41 -39.97 64.73 Favored 'General case' 0 N--CA 1.513 2.724 0 O-C-N 120.887 -1.133 . . . . 0.0 109.845 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -58.47 -30.79 67.25 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.293 -0.879 . . . . 0.0 110.222 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -68.05 -53.26 27.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.984 -1.072 . . . . 0.0 109.967 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' OH ' ' HG3' ' A' ' 47' ' ' GLN . 41.7 p90 -100.08 33.29 2.66 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.097 -1.002 . . . . 0.0 111.248 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -73.62 -39.11 64.8 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.771 -1.205 . . . . 0.0 110.112 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -110.16 32.35 5.2 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.553 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' HE3' ' A' ' 42' ' ' MET . 21.7 t90 -107.27 -57.9 2.02 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.152 -0.968 . . . . 0.0 110.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.463 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 2.1 ttm -140.5 63.08 1.48 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.271 -0.893 . . . . 0.0 109.627 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -45.17 -34.15 2.59 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.363 -0.836 . . . . 0.0 111.587 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -81.35 129.41 34.61 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.042 -1.036 . . . . 0.0 109.32 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 54.71 71.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.976 -1.078 . . . . 0.0 110.213 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -131.25 -174.02 3.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.362 -0.836 . . . . 0.0 110.445 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.453 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 56.76 34.03 23.95 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.346 -0.846 . . . . 0.0 110.542 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.96 -56.57 2.31 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.11 -0.993 . . . . 0.0 109.368 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -22.2 62.12 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.223 -0.923 . . . . 0.0 111.213 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.743 HD12 HG11 ' A' ' 34' ' ' VAL . 42.5 mm -64.13 -42.78 96.66 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 120.702 -1.249 . . . . 0.0 108.991 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.73 -37.25 73.25 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.335 -0.853 . . . . 0.0 110.391 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -72.1 -34.55 68.73 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.617 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.4 m . . . . . 0 N--CA 1.506 2.373 0 O-C-N 121.006 -1.059 . . . . 0.0 110.167 179.919 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 mttt . . . . . 0 N--CA 1.501 2.115 0 CA-C-O 120.939 0.4 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.571 ' HD1' HD13 ' A' ' 13' ' ' LEU . 77.5 t80 -125.57 162.45 24.91 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.128 -0.982 . . . . 0.0 110.137 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -131.91 135.71 46.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.226 -0.921 . . . . 0.0 110.535 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -112.79 95.55 5.48 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.175 -0.953 . . . . 0.0 109.731 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.85 -35.24 31.51 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.16 -0.962 . . . . 0.0 110.725 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.858 ' CD1' HG13 ' A' ' 34' ' ' VAL . 74.3 m-85 -63.54 -30.64 71.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.094 -1.004 . . . . 0.0 110.155 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.6 m -100.01 -8.83 23.38 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.968 -1.082 . . . . 0.0 112.107 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 t0 55.91 40.64 30.5 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.368 -1.458 . . . . 0.0 110.121 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.04 173.64 11.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.313 -0.867 . . . . 0.0 109.957 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -120.64 131.13 54.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.685 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.571 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -88.42 172.04 9.67 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.239 -0.913 . . . . 0.0 109.567 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -98.3 -31.93 11.8 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.148 -0.97 . . . . 0.0 111.469 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 28.1 m-70 -121.04 134.65 55.29 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.807 -1.183 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.401 ' OD1' ' CD2' ' A' ' 4' ' ' PHE . 24.0 t0 -113.06 97.27 6.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.149 -0.97 . . . . 0.0 109.895 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -144.34 179.4 1.18 Allowed Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.225 -0.922 . . . . 0.0 110.015 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.19 -31.32 14.69 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.303 1.16 . . . . 0.0 110.853 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.8 t -86.16 -38.97 17.15 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.923 -1.11 . . . . 0.0 110.069 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 15' ' ' HIS . 80.7 t -67.61 -46.35 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.119 -0.988 . . . . 0.0 109.751 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.0 mtp180 -56.92 -52.34 65.57 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.054 -1.028 . . . . 0.0 109.757 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -60.67 -40.19 91.21 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.156 -0.965 . . . . 0.0 108.871 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.6 m -55.09 -43.37 73.89 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.101 -0.999 . . . . 0.0 108.515 178.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -62.29 -38.48 89.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.396 -0.815 . . . . 0.0 109.004 178.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -94.92 52.81 1.51 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.22 -0.925 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -117.66 39.47 3.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 109.899 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -132.78 160.11 23.71 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -88.32 -10.99 47.64 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.334 -1.098 . . . . 0.0 110.83 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtpp -91.14 -24.35 19.99 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.582 -1.324 . . . . 0.0 111.212 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.693 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.5 t-80 -48.9 -38.51 22.86 Favored 'General case' 0 N--CA 1.517 2.897 0 O-C-N 120.813 -1.179 . . . . 0.0 110.813 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -64.94 -54.41 31.04 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.24 -0.984 . . . . 0.0 108.906 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.03 -39.26 89.13 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.229 -0.92 . . . . 0.0 109.073 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -56.98 -37.18 71.27 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.13 -0.981 . . . . 0.0 110.021 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.858 HG13 ' CD1' ' A' ' 8' ' ' TYR . 71.8 t -55.85 -37.98 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 O-C-N 120.975 -1.078 . . . . 0.0 110.079 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.0 tttt -58.98 -42.96 91.21 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.057 -1.027 . . . . 0.0 109.293 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -59.35 -26.3 64.93 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.467 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -74.43 -51.92 13.54 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.875 -1.141 . . . . 0.0 110.426 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 34.4 p90 -99.41 31.98 2.93 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.057 -1.027 . . . . 0.0 111.495 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -76.16 -40.25 52.98 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.724 -1.235 . . . . 0.0 110.131 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mttp -84.65 -32.04 23.86 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.248 -0.908 . . . . 0.0 110.182 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 5.9 t90 -50.21 -45.31 53.63 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.971 -1.081 . . . . 0.0 111.058 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.468 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -114.72 -55.3 2.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 110.341 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 53.65 38.34 28.1 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.978 -1.076 . . . . 0.0 110.739 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -157.55 -56.66 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.183 -0.948 . . . . 0.0 110.761 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -164.18 82.77 0.42 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.165 -0.959 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.461 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -138.77 72.53 1.41 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.29 36.63 4.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.259 -0.901 . . . . 0.0 110.277 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.39 -53.85 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.148 -0.97 . . . . 0.0 109.745 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.37 -21.41 62.1 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.255 -0.903 . . . . 0.0 111.522 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.698 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -71.75 -50.68 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 O-C-N 120.608 -1.308 . . . . 0.0 109.521 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -64.86 -39.39 93.48 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.274 -0.891 . . . . 0.0 109.915 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -33.43 64.26 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.095 -1.003 . . . . 0.0 110.731 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.505 2.28 0 O-C-N 120.968 -1.083 . . . . 0.0 110.682 179.988 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 61.4 mttt . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.592 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.2 t80 -108.04 161.45 14.94 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.28 -0.888 . . . . 0.0 110.164 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -135.05 137.45 42.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.283 -0.886 . . . . 0.0 110.002 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.7 t -119.26 96.91 5.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.101 -0.999 . . . . 0.0 110.294 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.87 -35.9 62.05 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.053 -1.029 . . . . 0.0 110.293 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.608 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.6 m-85 -60.59 -32.89 71.98 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.122 -0.986 . . . . 0.0 110.117 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.2 m -97.34 -4.37 38.69 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.061 -1.025 . . . . 0.0 112.198 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 53.45 39.4 29.9 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.376 -1.452 . . . . 0.0 110.573 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.76 170.06 16.4 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.294 -0.879 . . . . 0.0 109.992 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 14.6 t80 -118.41 134.05 55.38 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.322 -0.861 . . . . 0.0 110.423 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.592 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.7 mp -90.09 161.81 15.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.191 -0.943 . . . . 0.0 109.664 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.434 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.69 -21.95 16.16 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.101 -0.999 . . . . 0.0 111.888 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.776 ' HB2' HG11 ' A' ' 20' ' ' VAL . 42.7 m-70 -115.28 143.94 44.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.635 -1.291 . . . . 0.0 110.11 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -125.78 92.29 3.57 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 109.715 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.57 178.57 1.45 Allowed Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.229 -0.919 . . . . 0.0 110.043 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -70.82 -28.67 19.84 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.438 1.23 . . . . 0.0 111.078 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.61 -41.6 10.67 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.882 -1.136 . . . . 0.0 110.004 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.776 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.9 t -59.44 -54.05 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.093 -1.005 . . . . 0.0 109.728 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 20.4 mtp-105 -56.17 -50.52 70.95 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.163 -0.961 . . . . 0.0 109.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -61.99 -40.44 95.64 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.334 -0.946 . . . . 0.0 108.818 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.4 m -54.5 -43.07 71.49 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.117 -0.989 . . . . 0.0 108.368 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -62.45 -37.55 86.33 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.392 -0.818 . . . . 0.0 108.886 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -99.26 45.17 1.0 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.261 -0.899 . . . . 0.0 110.448 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -116.6 38.14 3.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.215 -0.928 . . . . 0.0 110.182 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.17 128.71 3.79 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.9 ttp85 -55.38 -27.49 47.87 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.225 -1.162 . . . . 0.0 110.545 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -62.53 -33.53 75.09 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.996 -1.065 . . . . 0.0 110.669 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.622 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.2 t-80 -51.32 -39.0 56.0 Favored 'General case' 0 N--CA 1.516 2.851 0 O-C-N 120.877 -1.139 . . . . 0.0 110.508 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -63.21 -55.1 27.81 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.35 -0.94 . . . . 0.0 109.057 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.01 -39.52 86.1 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.211 -0.93 . . . . 0.0 109.111 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -56.6 -38.27 71.79 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.17 -0.956 . . . . 0.0 110.012 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.675 HG11 HD12 ' A' ' 50' ' ' ILE . 71.5 t -56.73 -35.01 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.121 -0.987 . . . . 0.0 110.123 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 33.6 tttt -53.32 -44.57 68.5 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.812 -1.18 . . . . 0.0 109.932 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.42 -28.89 65.67 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.282 -0.887 . . . . 0.0 110.407 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -74.31 -50.75 17.53 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.947 -1.096 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.602 ' CE2' HG12 ' A' ' 34' ' ' VAL . 37.9 p90 -99.31 34.42 2.18 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.029 -1.044 . . . . 0.0 111.451 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -90.97 -41.21 11.25 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.723 -1.235 . . . . 0.0 109.656 178.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -112.53 32.83 5.33 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.346 -0.846 . . . . 0.0 110.26 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 16.2 t90 -97.7 -41.87 7.89 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.185 -0.947 . . . . 0.0 110.439 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.462 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -115.69 -67.96 0.96 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.063 -1.023 . . . . 0.0 110.108 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -167.17 -60.66 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.15 -0.969 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.21 -51.52 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.074 -1.016 . . . . 0.0 111.093 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -81.12 89.0 5.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.111 -0.993 . . . . 0.0 110.3 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.401 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -145.78 69.42 1.22 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.236 -0.915 . . . . 0.0 110.136 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -122.32 35.38 4.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.552 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -108.16 -52.68 2.73 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.194 -0.941 . . . . 0.0 109.499 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -20.94 63.34 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 111.478 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.675 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.77 -56.18 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 120.699 -1.251 . . . . 0.0 109.806 179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -56.97 -39.43 74.59 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.167 -0.958 . . . . 0.0 110.312 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -57.13 -36.47 70.73 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.117 -0.99 . . . . 0.0 110.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.505 2.284 0 O-C-N 121.063 -1.023 . . . . 0.0 110.541 179.806 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.441 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 16.8 mtmt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -110.88 152.07 27.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.221 -0.924 . . . . 0.0 109.629 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -128.95 136.0 49.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.2 t -110.15 94.5 5.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 110.168 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -51.73 -35.57 43.72 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.051 -1.03 . . . . 0.0 110.459 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.86 ' CD1' HG13 ' A' ' 34' ' ' VAL . 78.3 m-85 -61.85 -32.2 72.51 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.174 -0.953 . . . . 0.0 110.057 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.4 m -98.29 -0.96 42.92 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.993 -1.067 . . . . 0.0 112.146 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 52.25 38.87 25.87 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.407 -1.433 . . . . 0.0 110.69 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -140.21 171.23 14.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 109.978 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.441 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.4 OUTLIER -122.1 119.14 30.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.205 -0.935 . . . . 0.0 110.145 -179.758 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -75.99 166.71 23.09 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.145 -0.972 . . . . 0.0 109.489 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -100.37 -30.38 11.88 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.153 -0.967 . . . . 0.0 111.725 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.652 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.3 m-70 -112.44 142.18 45.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.732 -1.23 . . . . 0.0 110.154 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.41 89.71 3.18 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.184 -0.948 . . . . 0.0 109.714 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -136.59 178.44 1.74 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.847 . . . . 0.0 110.046 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.53 -29.94 19.46 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.8 m -90.32 -43.63 10.22 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.923 -1.11 . . . . 0.0 109.91 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.652 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.58 -53.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.632 0 O-C-N 121.184 -0.948 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 mtp-105 -56.76 -50.22 72.91 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.145 -0.972 . . . . 0.0 109.699 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -61.93 -40.29 94.98 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.316 -0.954 . . . . 0.0 108.802 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.7 m -54.53 -42.66 71.16 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.013 -1.054 . . . . 0.0 108.684 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -61.69 -37.63 84.83 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.167 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.32 53.12 1.47 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.234 -0.916 . . . . 0.0 110.423 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.71 38.22 3.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.1 -1.0 . . . . 0.0 110.101 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.25 130.01 4.45 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 -59.29 -23.98 62.88 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.231 -1.158 . . . . 0.0 110.854 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -71.06 -27.48 63.67 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 120.819 -1.176 . . . . 0.0 111.45 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.7 t-80 -49.55 -37.89 28.88 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.735 -1.228 . . . . 0.0 110.806 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -63.17 -54.2 41.38 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.087 -1.008 . . . . 0.0 109.112 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -60.46 -40.14 90.14 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.144 -0.972 . . . . 0.0 109.057 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -55.98 -37.22 68.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.223 -0.923 . . . . 0.0 110.046 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.86 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.8 t -55.92 -33.64 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.589 0 O-C-N 121.129 -0.982 . . . . 0.0 110.291 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 5.0 tttt -53.2 -41.94 65.79 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.825 -1.172 . . . . 0.0 109.994 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.56 -27.77 64.89 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.437 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.02 -52.26 13.3 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.877 -1.139 . . . . 0.0 110.499 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.905 ' CE2' ' HB3' ' A' ' 46' ' ' ALA . 35.5 p90 -99.01 31.63 2.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.004 -1.06 . . . . 0.0 111.656 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.59 -38.3 59.2 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.661 -1.274 . . . . 0.0 110.027 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.7 mttt -113.28 34.24 4.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.255 -0.903 . . . . 0.0 110.563 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -98.21 -47.12 5.58 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -148.14 -63.63 0.25 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.352 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -120.24 -177.29 3.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.305 -0.872 . . . . 0.0 110.251 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -97.72 -37.73 9.77 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.19 -0.943 . . . . 0.0 110.68 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -109.72 112.33 24.33 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.049 -1.032 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.905 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -148.74 76.74 1.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.217 -0.927 . . . . 0.0 110.242 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -106.48 35.71 2.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.063 -1.023 . . . . 0.0 110.462 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.9 -55.17 2.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.069 -1.019 . . . . 0.0 109.276 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.262 -0.899 . . . . 0.0 111.316 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -70.37 -44.78 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.7 -1.25 . . . . 0.0 109.514 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -58.13 -40.8 82.2 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.189 -0.944 . . . . 0.0 110.029 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -61.19 -34.91 75.84 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.234 -0.916 . . . . 0.0 110.483 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m . . . . . 0 N--CA 1.505 2.293 0 O-C-N 120.979 -1.076 . . . . 0.0 110.174 179.917 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 mttt . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.612 ' HD1' HD13 ' A' ' 13' ' ' LEU . 71.7 t80 -111.86 162.66 15.05 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.269 -0.894 . . . . 0.0 110.01 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -137.75 137.1 37.94 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.033 -1.042 . . . . 0.0 110.853 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.2 t -114.23 100.74 8.58 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.177 -0.952 . . . . 0.0 109.91 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -58.09 -37.08 73.83 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.098 -1.002 . . . . 0.0 110.704 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -61.4 -34.96 76.23 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 120.996 -1.065 . . . . 0.0 110.046 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.6 m -90.03 -4.12 57.58 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.095 -1.003 . . . . 0.0 111.826 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.9 t70 53.74 39.4 30.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.393 -1.442 . . . . 0.0 110.473 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.18 171.89 13.44 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.279 -0.888 . . . . 0.0 109.995 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.4 120.81 37.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.243 -0.911 . . . . 0.0 110.086 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.612 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -74.7 166.91 22.81 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.13 -0.981 . . . . 0.0 109.559 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.497 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -101.12 -29.44 12.13 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.106 -0.996 . . . . 0.0 111.889 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.591 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.4 m-70 -114.62 148.11 38.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.782 -1.199 . . . . 0.0 110.342 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -124.59 97.52 5.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.203 -0.936 . . . . 0.0 109.764 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.29 178.08 1.56 Allowed Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.226 -0.921 . . . . 0.0 110.263 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -70.56 -30.67 18.24 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 O-C-N 123.405 1.213 . . . . 0.0 110.93 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.7 m -90.32 -39.78 12.52 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.978 -1.076 . . . . 0.0 109.989 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.591 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.5 t -60.2 -52.34 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.034 -1.041 . . . . 0.0 109.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -57.61 -49.39 76.56 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 121.13 -0.981 . . . . 0.0 109.583 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -41.4 99.09 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.728 178.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 78.8 m -54.59 -43.33 72.05 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.157 -0.964 . . . . 0.0 108.493 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.87 -37.16 85.76 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.648 -0.821 . . . . 0.0 109.062 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 50.32 1.04 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.206 -0.934 . . . . 0.0 110.331 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.22 38.11 3.32 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.057 -1.027 . . . . 0.0 110.382 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.34 126.41 2.39 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.836 -1.305 . . . . 0.0 109.836 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -53.75 -28.92 37.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.211 -1.17 . . . . 0.0 110.263 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -59.13 -32.74 70.12 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.05 -1.031 . . . . 0.0 110.605 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.499 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.54 -37.08 25.6 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.92 -1.112 . . . . 0.0 111.043 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -60.67 -53.62 55.27 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.071 -1.018 . . . . 0.0 109.157 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -39.03 85.52 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.181 -0.95 . . . . 0.0 109.03 178.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -56.03 -37.16 68.83 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.281 -0.887 . . . . 0.0 110.18 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.852 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.3 t -58.83 -37.2 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.06 -1.025 . . . . 0.0 109.796 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CZ ' ' A' ' 38' ' ' TYR . 9.0 tttp -54.76 -40.83 69.77 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.93 -1.106 . . . . 0.0 109.716 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.59 -32.4 70.35 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.95 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -65.51 -51.32 60.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.997 -1.064 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.656 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.8 p90 -99.87 34.21 2.35 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.06 -1.025 . . . . 0.0 111.323 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -39.21 15.87 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.813 -1.179 . . . . 0.0 109.733 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -114.27 34.55 4.63 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.237 -0.914 . . . . 0.0 110.358 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.459 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.6 t90 -88.5 -47.61 8.2 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.181 -0.949 . . . . 0.0 110.162 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.459 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -151.98 -64.18 0.17 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.182 -0.949 . . . . 0.0 110.639 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -129.24 -171.48 2.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.221 -0.924 . . . . 0.0 110.147 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -109.52 -179.74 3.91 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.22 -0.925 . . . . 0.0 110.14 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 53.27 74.56 0.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.121 -0.987 . . . . 0.0 110.687 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.443 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -135.23 73.5 1.48 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.271 -0.893 . . . . 0.0 110.166 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -112.18 35.19 3.86 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.203 -0.936 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.09 -54.21 2.56 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.054 -1.029 . . . . 0.0 109.325 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -21.24 63.1 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.268 -0.895 . . . . 0.0 111.334 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.628 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -74.05 -43.31 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.646 -1.284 . . . . 0.0 109.536 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -64.53 -39.97 94.76 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.234 -0.916 . . . . 0.0 109.978 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -63.58 -33.64 76.05 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.229 -0.92 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.4 m . . . . . 0 N--CA 1.505 2.315 0 O-C-N 121.066 -1.021 . . . . 0.0 110.39 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.9 mttt . . . . . 0 N--CA 1.502 2.141 0 CA-C-O 121.002 0.429 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.58 ' HD2' HD13 ' A' ' 13' ' ' LEU . 79.9 t80 -124.89 162.21 24.9 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.11 -0.994 . . . . 0.0 109.912 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -139.7 132.43 29.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.231 -0.918 . . . . 0.0 110.434 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 t -112.84 89.88 3.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.204 -0.935 . . . . 0.0 109.973 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -51.31 -35.77 39.41 Favored 'General case' 0 N--CA 1.515 2.82 0 O-C-N 121.05 -1.031 . . . . 0.0 110.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.897 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.0 m-85 -59.92 -31.0 69.42 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.117 -0.99 . . . . 0.0 110.063 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.3 m -99.41 -0.15 41.48 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.929 -1.107 . . . . 0.0 112.239 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 52.84 38.41 26.63 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.326 -1.484 . . . . 0.0 110.656 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -142.16 170.46 15.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.224 -0.923 . . . . 0.0 110.022 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -121.45 142.92 49.56 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.212 -0.93 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.58 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -102.73 156.58 17.54 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.251 -0.906 . . . . 0.0 109.406 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.419 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -98.86 -30.83 12.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.13 -0.981 . . . . 0.0 111.594 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.456 ' O ' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -111.19 126.93 55.38 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.814 -1.179 . . . . 0.0 110.175 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -110.03 92.52 4.08 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.237 -0.915 . . . . 0.0 109.647 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.45 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -135.61 -179.72 1.15 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.43 -0.794 . . . . 0.0 109.765 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.72 -28.35 17.13 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.185 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.84 -43.55 9.97 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.881 -1.137 . . . . 0.0 110.07 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.456 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.5 t -59.14 -53.29 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.57 0 O-C-N 121.039 -1.038 . . . . 0.0 109.838 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.95 -50.14 73.54 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.074 -1.016 . . . . 0.0 109.625 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -61.91 -40.8 96.7 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.133 -0.98 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.6 m -54.56 -43.43 72.03 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.075 -1.016 . . . . 0.0 108.496 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -63.35 -40.91 98.57 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -93.25 56.61 2.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.342 -0.849 . . . . 0.0 110.197 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -119.11 37.09 4.23 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.131 -0.981 . . . . 0.0 110.401 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.29 123.37 1.74 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -51.12 -30.39 16.18 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.204 -1.174 . . . . 0.0 110.672 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -57.66 -33.79 68.7 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.013 -1.054 . . . . 0.0 110.596 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.49 -42.43 54.68 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.92 -1.113 . . . . 0.0 110.728 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -62.97 -53.31 56.07 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.107 -0.996 . . . . 0.0 109.055 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.68 88.89 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.232 -0.918 . . . . 0.0 109.04 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -55.66 -38.61 69.82 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.215 -0.928 . . . . 0.0 110.024 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.897 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.4 t -61.62 -38.76 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 121.176 -0.952 . . . . 0.0 109.662 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 12.8 mtmt -58.45 -45.24 88.96 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.053 -1.029 . . . . 0.0 109.395 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.92 -25.66 63.66 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.274 -0.891 . . . . 0.0 110.362 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -72.9 -50.78 21.62 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.84 -1.162 . . . . 0.0 110.583 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.516 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 37.6 p90 -99.85 34.88 2.15 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.994 -1.067 . . . . 0.0 111.464 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -38.96 14.22 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.769 -1.207 . . . . 0.0 109.871 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.42 32.02 6.07 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.268 -0.895 . . . . 0.0 110.663 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 17.4 t90 -85.39 -37.93 19.29 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.126 -0.984 . . . . 0.0 110.315 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.453 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.9 mtm -142.48 -67.36 0.38 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.103 -0.998 . . . . 0.0 110.206 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -156.98 38.82 0.31 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.095 -1.003 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 52.05 38.33 23.74 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.087 -1.008 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.37 74.8 1.55 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.104 -0.997 . . . . 0.0 110.2 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -154.83 73.44 0.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.199 -0.938 . . . . 0.0 110.687 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.45 35.15 4.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.947 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.4 t -109.86 -54.74 2.53 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.154 -0.966 . . . . 0.0 109.369 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.12 -20.01 64.97 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.282 -0.886 . . . . 0.0 111.365 179.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.812 HD12 HG11 ' A' ' 34' ' ' VAL . 50.0 mm -74.64 -41.09 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.698 -1.251 . . . . 0.0 109.914 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.29 -39.62 86.02 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.909 . . . . 0.0 110.146 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -56.3 -37.09 69.42 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.095 -1.003 . . . . 0.0 110.47 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.0 m . . . . . 0 N--CA 1.505 2.286 0 O-C-N 121.227 -0.921 . . . . 0.0 110.567 179.843 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 41.6 mttt . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.648 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.8 t80 -111.6 161.85 15.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.176 -0.953 . . . . 0.0 110.328 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -129.04 139.28 52.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.268 -0.895 . . . . 0.0 110.146 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -118.21 98.35 6.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.131 -0.981 . . . . 0.0 109.912 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.98 -36.05 48.47 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 121.033 -1.042 . . . . 0.0 110.75 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.817 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.2 m-85 -63.48 -30.92 71.96 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.036 -1.04 . . . . 0.0 110.254 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.0 m -99.46 -11.11 21.39 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.981 -1.075 . . . . 0.0 112.03 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t0 56.72 40.89 28.93 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.409 -1.432 . . . . 0.0 110.076 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -141.56 172.95 11.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.248 -0.907 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.5 t80 -119.92 128.41 53.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.304 -0.873 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.648 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.2 mp -82.27 169.75 16.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.2 -0.937 . . . . 0.0 109.732 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.445 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.0 t -97.43 -31.99 12.08 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.169 -0.957 . . . . 0.0 111.346 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.445 ' CG ' HG23 ' A' ' 14' ' ' THR . 30.4 m170 -116.04 137.6 51.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.91 -1.118 . . . . 0.0 110.126 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -114.19 96.44 5.8 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.209 -0.932 . . . . 0.0 109.838 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.36 177.96 1.61 Allowed Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.256 -0.902 . . . . 0.0 110.172 -179.707 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.02 -31.21 15.34 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.372 1.196 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.6 m -87.2 -39.76 15.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.912 -1.117 . . . . 0.0 110.084 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.433 HG11 ' O ' ' A' ' 15' ' ' HIS . 86.2 t -61.02 -47.81 91.9 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.226 -0.921 . . . . 0.0 109.716 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 20.5 mtt180 -57.53 -53.73 54.81 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.146 -0.972 . . . . 0.0 109.725 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -60.61 -40.08 90.54 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.191 -0.943 . . . . 0.0 109.009 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.1 m -56.22 -43.44 78.56 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.083 -1.011 . . . . 0.0 108.421 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.32 -36.87 81.34 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.028 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -97.48 49.38 1.04 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.146 -0.971 . . . . 0.0 110.389 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.82 37.76 3.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.12 -0.988 . . . . 0.0 110.284 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.61 129.51 4.02 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -54.42 -28.57 44.85 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.152 -1.205 . . . . 0.0 110.481 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -61.2 -35.16 76.43 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.996 -1.065 . . . . 0.0 110.503 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.491 ' O ' HG23 ' A' ' 34' ' ' VAL . 10.0 t-80 -51.68 -38.45 55.07 Favored 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.908 -1.12 . . . . 0.0 110.599 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -61.6 -55.74 27.41 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.114 -0.991 . . . . 0.0 109.245 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -58.97 -38.51 79.27 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.206 -0.934 . . . . 0.0 109.173 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.18 -38.33 70.79 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.163 -0.961 . . . . 0.0 110.128 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.854 ' CG1' HD12 ' A' ' 50' ' ' ILE . 98.2 t -63.52 -36.85 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.099 -1.001 . . . . 0.0 109.847 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -52.53 -40.58 62.62 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.007 -1.058 . . . . 0.0 109.821 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.71 -30.14 65.28 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.314 -0.866 . . . . 0.0 110.316 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.46 -53.48 19.03 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.885 -1.134 . . . . 0.0 109.946 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -100.11 34.39 2.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 111.198 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.77 -36.96 56.68 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 120.781 -1.199 . . . . 0.0 110.341 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.21 22.99 13.1 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.101 -0.999 . . . . 0.0 111.294 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.8 t90 -104.89 -49.46 3.49 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.865 -1.147 . . . . 0.0 110.238 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -103.54 -46.7 4.48 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.127 -0.983 . . . . 0.0 110.299 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 53.7 38.5 28.55 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.984 -1.073 . . . . 0.0 110.775 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -156.93 -65.82 0.1 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.634 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -164.69 77.68 0.33 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.18 -0.95 . . . . 0.0 110.788 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.54 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -122.84 73.7 1.16 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.166 -0.959 . . . . 0.0 110.431 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.1 35.9 4.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.284 -0.885 . . . . 0.0 110.388 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.0 m -111.21 -52.9 2.75 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.106 -0.996 . . . . 0.0 109.798 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.2 -21.3 61.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.134 -0.979 . . . . 0.0 111.551 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.854 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.4 mm -70.75 -38.61 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 120.719 -1.238 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -86.62 -39.97 15.6 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.106 -0.996 . . . . 0.0 110.065 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -64.27 -31.79 73.13 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.222 -0.924 . . . . 0.0 110.652 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.3 m . . . . . 0 N--CA 1.505 2.304 0 O-C-N 120.964 -1.085 . . . . 0.0 110.418 -179.901 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.2 mttp . . . . . 0 N--CA 1.501 2.116 0 CA-C-O 120.925 0.393 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -126.38 162.36 25.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.103 -0.998 . . . . 0.0 110.093 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -141.25 132.01 25.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -0.956 . . . . 0.0 110.393 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.4 t -110.63 88.87 2.88 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.203 -0.935 . . . . 0.0 109.553 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -50.96 -36.48 39.15 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.153 -0.967 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.975 ' CD2' HG13 ' A' ' 34' ' ' VAL . 26.6 m-85 -61.79 -30.55 70.89 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.041 -1.037 . . . . 0.0 110.127 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.0 m -98.15 -0.88 43.46 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.997 -1.064 . . . . 0.0 111.997 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 53.01 38.27 26.82 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.423 -1.423 . . . . 0.0 110.791 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.9 t -139.59 168.05 20.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.155 -0.966 . . . . 0.0 109.872 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -120.91 143.77 48.78 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.155 -0.966 . . . . 0.0 110.637 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.25 140.23 39.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -102.33 -21.03 14.38 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.074 -1.016 . . . . 0.0 112.441 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.555 ' CB ' HG21 ' A' ' 20' ' ' VAL . 40.0 m-70 -103.58 67.49 0.9 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.636 -1.29 . . . . 0.0 110.02 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.44 101.7 0.11 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.24 -0.912 . . . . 0.0 110.038 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.72 178.18 1.57 Allowed Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.026 -1.046 . . . . 0.0 110.251 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.88 -30.17 17.46 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.403 1.212 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 40.3 m -90.26 -40.77 11.96 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.888 -1.133 . . . . 0.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.555 HG21 ' CB ' ' A' ' 15' ' ' HIS . 98.1 t -59.6 -56.16 19.06 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.626 0 O-C-N 121.053 -1.029 . . . . 0.0 109.75 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.7 mtp85 -55.27 -50.28 69.92 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.072 -1.017 . . . . 0.0 109.899 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -62.34 -40.64 97.04 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.285 -0.966 . . . . 0.0 108.802 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 52.9 m -55.5 -43.08 75.32 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.097 -1.002 . . . . 0.0 108.368 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -64.73 -37.79 88.78 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.6 -0.84 . . . . 0.0 108.953 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -97.63 57.0 1.33 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.171 -0.956 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.13 37.73 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.129 -0.982 . . . . 0.0 110.443 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.13 122.69 1.25 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.84 -29.61 28.88 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.091 -1.241 . . . . 0.0 110.134 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -56.78 -31.99 65.21 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 33.9 t-80 -47.34 -38.64 13.29 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.132 -0.98 . . . . 0.0 111.306 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -55.06 26.74 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.006 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -59.49 -39.1 82.68 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.183 -0.948 . . . . 0.0 109.092 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -54.64 -36.38 64.47 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.194 -0.941 . . . . 0.0 110.261 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.975 HG13 ' CD2' ' A' ' 8' ' ' TYR . 89.1 t -55.34 -37.81 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.733 0 O-C-N 121.056 -1.027 . . . . 0.0 110.093 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 7.1 tttp -54.26 -39.67 67.07 Favored 'General case' 0 N--CA 1.514 2.737 0 O-C-N 121.073 -1.017 . . . . 0.0 109.894 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -59.8 -32.26 70.47 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.036 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 33.5 t80 -64.87 -52.17 58.06 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.954 -1.091 . . . . 0.0 110.169 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.535 ' HE2' HG12 ' A' ' 34' ' ' VAL . 49.3 p90 -100.38 34.69 2.31 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.097 -1.002 . . . . 0.0 111.15 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.6 14.56 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.736 -1.228 . . . . 0.0 109.788 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.36 34.47 4.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.247 -0.908 . . . . 0.0 110.415 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.486 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.7 t90 -93.5 -38.82 11.21 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.153 -0.967 . . . . 0.0 110.273 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.486 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.3 ttm -145.87 -62.19 0.33 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.177 -0.952 . . . . 0.0 110.392 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -143.35 -164.46 1.87 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.182 -0.949 . . . . 0.0 110.05 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.29 39.26 2.34 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.111 -0.993 . . . . 0.0 110.201 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -150.41 75.1 1.21 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.47 72.1 1.39 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.214 -0.928 . . . . 0.0 110.181 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.06 35.92 4.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.343 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -110.28 -54.94 2.52 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.147 -0.97 . . . . 0.0 109.309 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -21.06 64.12 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.204 -0.935 . . . . 0.0 111.208 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 34' ' ' VAL . 48.3 mm -74.36 -54.59 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.653 -1.28 . . . . 0.0 109.517 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -55.56 -39.67 70.94 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.14 -0.975 . . . . 0.0 110.3 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.7 tttt -59.74 -37.15 78.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.128 -0.983 . . . . 0.0 110.304 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 m . . . . . 0 N--CA 1.504 2.264 0 O-C-N 121.064 -1.022 . . . . 0.0 110.076 179.83 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 5.7 mttt . . . . . 0 N--CA 1.494 1.772 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.652 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.9 t80 -110.72 161.49 15.71 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.128 -0.983 . . . . 0.0 110.491 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 34.7 t80 -135.58 134.58 39.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.225 -0.922 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 39.3 t -114.27 96.67 5.91 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.125 -0.984 . . . . 0.0 110.1 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -53.52 -36.2 61.5 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.075 -1.016 . . . . 0.0 110.468 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.706 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -61.45 -32.76 72.75 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.138 -0.976 . . . . 0.0 110.074 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.9 m -96.51 -5.33 39.68 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.996 -1.065 . . . . 0.0 112.187 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 53.44 39.86 30.53 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.441 -1.412 . . . . 0.0 110.388 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -141.62 172.09 13.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.332 -0.855 . . . . 0.0 109.956 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.431 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 13.0 t80 -119.41 137.89 53.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.315 -0.866 . . . . 0.0 110.479 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.652 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.9 mp -96.59 168.29 10.62 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.237 -0.915 . . . . 0.0 109.587 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.412 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.2 t -98.88 -30.13 12.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.166 -0.958 . . . . 0.0 111.777 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.587 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.2 m170 -113.06 148.73 34.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.909 -1.119 . . . . 0.0 110.413 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -126.56 96.88 4.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.338 -0.851 . . . . 0.0 109.678 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -150.46 178.5 1.49 Allowed Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.258 -0.901 . . . . 0.0 110.283 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.6 Cg_endo -70.43 -32.01 16.55 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.37 1.195 . . . . 0.0 110.897 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.2 m -86.07 -40.34 15.83 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 120.929 -1.107 . . . . 0.0 109.878 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 15' ' ' HIS . 77.8 t -61.94 -50.2 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.194 -0.941 . . . . 0.0 109.496 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.446 ' CD ' ' CE2' ' A' ' 4' ' ' PHE . 36.2 mtm-85 -57.45 -50.24 73.67 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.49 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.49 -40.91 96.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.139 -0.976 . . . . 0.0 108.674 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.1 m -54.57 -43.69 72.29 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.122 -0.987 . . . . 0.0 108.463 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -62.77 -39.99 95.89 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -93.07 55.75 2.4 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.267 -0.896 . . . . 0.0 110.35 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.89 37.29 4.25 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.063 -1.023 . . . . 0.0 110.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.87 126.95 2.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -28.3 42.98 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.126 -1.22 . . . . 0.0 110.462 179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -60.94 -32.4 71.92 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.972 -1.08 . . . . 0.0 110.708 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.553 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.22 -39.95 45.98 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.946 -1.096 . . . . 0.0 110.75 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 -52.81 60.1 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.071 -1.018 . . . . 0.0 108.89 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -61.26 -39.73 91.45 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.481 -0.888 . . . . 0.0 108.918 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -56.29 -38.56 71.39 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.237 -0.915 . . . . 0.0 109.981 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.706 HG13 ' CD2' ' A' ' 8' ' ' TYR . 73.5 t -56.84 -35.47 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.646 0 O-C-N 121.091 -1.005 . . . . 0.0 110.027 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.0 tttt -53.07 -42.82 66.22 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.999 -1.063 . . . . 0.0 109.935 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -57.51 -31.35 65.94 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.196 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -64.31 -51.3 64.13 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.991 -1.068 . . . . 0.0 110.148 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -100.37 33.62 2.63 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.152 -0.967 . . . . 0.0 111.352 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -91.16 -38.52 12.68 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.801 -1.187 . . . . 0.0 110.054 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -111.28 29.11 8.1 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.221 -0.924 . . . . 0.0 110.894 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.503 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 25.9 t90 -92.56 -40.07 11.0 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.002 -1.061 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.503 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.0 tpp -145.8 -60.4 0.33 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.073 -1.017 . . . . 0.0 110.286 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.32 -164.63 2.02 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.199 -0.938 . . . . 0.0 110.242 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -109.89 39.39 2.14 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.198 -0.939 . . . . 0.0 110.134 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -152.0 75.89 1.16 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.158 -0.964 . . . . 0.0 110.36 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -138.94 74.29 1.47 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.237 -0.914 . . . . 0.0 110.272 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -111.89 35.86 3.54 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.191 -0.943 . . . . 0.0 110.341 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.4 p -110.48 -53.78 2.65 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.172 -0.955 . . . . 0.0 109.547 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.31 63.3 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.252 -0.905 . . . . 0.0 111.322 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.653 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -73.27 -54.5 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 120.61 -1.306 . . . . 0.0 109.552 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -57.29 -39.49 75.83 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.185 -0.947 . . . . 0.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -63.85 -35.08 79.46 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.218 -0.926 . . . . 0.0 110.458 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.5 m . . . . . 0 N--CA 1.504 2.262 0 O-C-N 121.028 -1.045 . . . . 0.0 110.235 179.949 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.472 ' HD1' HD13 ' A' ' 13' ' ' LEU . 62.6 t80 -115.08 154.68 28.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.192 -0.943 . . . . 0.0 109.868 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 11' ' ' THR . 66.2 t80 -130.93 141.03 50.25 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.007 -1.058 . . . . 0.0 110.563 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.2 t -119.15 92.61 3.84 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.289 -0.882 . . . . 0.0 109.793 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -53.09 -36.48 60.75 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.093 -1.005 . . . . 0.0 111.064 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.791 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -62.15 -32.58 73.2 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 120.997 -1.064 . . . . 0.0 109.957 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 45.9 m -94.73 -1.33 53.2 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.989 -1.069 . . . . 0.0 111.934 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.88 38.27 28.34 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.304 -1.498 . . . . 0.0 110.439 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.406 ' O ' ' CD1' ' A' ' 5' ' ' TYR . 8.3 t -143.38 171.53 14.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.164 -0.96 . . . . 0.0 110.011 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.7 OUTLIER -129.86 131.26 46.04 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 109.954 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.472 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.5 mp -87.99 161.67 17.27 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.117 -0.989 . . . . 0.0 110.145 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -97.22 -29.98 13.26 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.998 -1.064 . . . . 0.0 111.6 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.428 ' HB2' HG11 ' A' ' 20' ' ' VAL . 47.9 m-70 -106.88 130.77 54.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.903 -1.123 . . . . 0.0 109.974 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -114.18 76.89 1.01 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.165 -0.959 . . . . 0.0 110.002 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -119.87 -179.11 0.65 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.278 -0.889 . . . . 0.0 109.934 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.9 Cg_endo -72.83 -26.56 15.6 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.292 1.154 . . . . 0.0 111.507 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.1 t -92.06 -42.71 9.81 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.752 -1.218 . . . . 0.0 110.196 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 15' ' ' HIS . 81.4 t -57.82 -53.12 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.018 . . . . 0.0 109.932 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 mtp180 -55.98 -51.12 68.84 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.023 -1.048 . . . . 0.0 109.809 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -61.98 -40.8 96.85 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.143 -0.973 . . . . 0.0 108.728 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -54.64 -43.03 71.96 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.215 -0.928 . . . . 0.0 108.504 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -62.88 -37.8 88.34 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 119.627 -0.829 . . . . 0.0 108.979 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -97.26 51.39 1.1 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.224 -0.922 . . . . 0.0 110.2 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.32 37.99 3.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.355 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.4 127.76 2.84 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.52 -28.33 44.57 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.205 -1.173 . . . . 0.0 110.496 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -61.12 -33.15 72.92 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.88 -1.138 . . . . 0.0 110.669 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.6 t-80 -50.33 -41.34 51.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.933 -1.105 . . . . 0.0 110.87 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -61.79 -56.08 23.27 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.236 179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -59.0 -38.02 78.23 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.159 -0.963 . . . . 0.0 109.157 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -56.35 -39.35 72.73 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.113 -0.992 . . . . 0.0 110.041 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.791 HG13 ' CD1' ' A' ' 8' ' ' TYR . 84.2 t -62.86 -39.28 84.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 109.544 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -59.59 -42.45 92.6 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.058 -1.026 . . . . 0.0 109.215 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.42 -31.48 69.31 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.062 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -69.85 -51.73 30.97 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.922 -1.111 . . . . 0.0 110.249 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.718 ' HE2' HG12 ' A' ' 34' ' ' VAL . 42.3 p90 -99.88 33.89 2.44 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.073 -1.017 . . . . 0.0 111.34 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -39.73 17.46 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.78 -1.2 . . . . 0.0 109.874 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -90.34 -29.65 17.94 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.25 -0.906 . . . . 0.0 110.372 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.1 t90 -46.6 -33.89 4.53 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.086 -1.009 . . . . 0.0 111.788 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.454 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.5 mtt -151.77 -55.22 0.14 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.992 -1.068 . . . . 0.0 111.198 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 59.26 40.08 21.82 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.902 -1.124 . . . . 0.0 110.027 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -147.41 85.91 1.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.224 -0.922 . . . . 0.0 110.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 53.55 74.22 0.33 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.001 -1.062 . . . . 0.0 110.635 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -143.4 69.45 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.21 -0.931 . . . . 0.0 110.207 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -129.95 32.75 4.5 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 0.0 110.634 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.6 m -102.89 -48.21 4.14 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.055 -1.028 . . . . 0.0 109.605 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -21.64 61.84 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.184 -0.948 . . . . 0.0 111.42 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.785 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -83.47 -40.84 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.368 0 O-C-N 120.601 -1.312 . . . . 0.0 109.938 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.72 -40.35 83.47 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.168 -0.958 . . . . 0.0 110.09 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.31 -35.51 67.62 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.581 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.1 m . . . . . 0 N--CA 1.504 2.263 0 O-C-N 121.047 -1.033 . . . . 0.0 110.531 179.793 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.5 mttt . . . . . 0 N--CA 1.495 1.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 47.8 t80 -111.1 157.08 20.42 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.131 -0.981 . . . . 0.0 110.144 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -129.72 137.88 50.82 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.201 -0.937 . . . . 0.0 110.31 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.9 t -115.59 96.36 5.59 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.206 -0.934 . . . . 0.0 110.223 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -54.02 -36.35 62.9 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.057 -1.027 . . . . 0.0 110.341 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.778 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.7 m-85 -60.26 -33.97 73.07 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.071 -1.018 . . . . 0.0 110.039 179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' HG22 ' A' ' 11' ' ' THR . 38.0 m -94.73 0.88 55.36 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.118 -0.989 . . . . 0.0 112.036 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.49 37.56 19.76 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.468 -1.395 . . . . 0.0 110.797 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.413 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.1 t -146.26 171.26 15.22 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.24 -0.913 . . . . 0.0 110.173 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.17 124.55 47.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.043 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.413 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.5 mp -73.41 167.15 21.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.228 -0.92 . . . . 0.0 109.668 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.413 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.0 t -101.12 -28.46 12.68 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.139 -0.976 . . . . 0.0 111.951 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.691 ' HB2' HG11 ' A' ' 20' ' ' VAL . 40.6 m-70 -111.22 144.67 40.0 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.726 -1.234 . . . . 0.0 110.167 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -123.09 92.58 3.73 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 109.887 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -141.82 178.26 1.59 Allowed Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.243 -0.911 . . . . 0.0 110.047 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.43 -30.81 14.8 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.465 1.245 . . . . 0.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 t -89.96 -40.5 12.32 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.947 -1.096 . . . . 0.0 109.991 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.3 t -58.96 -53.17 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.125 -0.985 . . . . 0.0 109.787 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 32.9 mtm180 -56.81 -51.57 68.46 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.075 -1.016 . . . . 0.0 109.735 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -61.82 -40.17 94.34 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.286 -0.966 . . . . 0.0 108.968 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.4 -42.61 74.29 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.053 -1.029 . . . . 0.0 108.482 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.93 -36.35 83.14 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.348 -0.845 . . . . 0.0 109.172 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.69 46.37 0.97 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.172 -0.955 . . . . 0.0 110.448 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.58 38.51 3.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.108 -0.995 . . . . 0.0 110.199 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.34 126.49 2.6 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -28.27 45.41 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.185 -1.186 . . . . 0.0 110.287 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -58.35 -33.95 70.11 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.894 -1.128 . . . . 0.0 110.479 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.45 -37.65 39.41 Favored 'General case' 0 N--CA 1.516 2.834 0 O-C-N 120.963 -1.086 . . . . 0.0 110.733 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -55.56 28.58 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.027 -1.046 . . . . 0.0 109.126 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.19 -39.25 82.01 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.238 -0.914 . . . . 0.0 109.179 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.53 -37.43 70.45 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.218 -0.926 . . . . 0.0 110.072 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.778 HG13 ' CD2' ' A' ' 8' ' ' TYR . 87.2 t -57.9 -37.67 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.023 -1.048 . . . . 0.0 109.944 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 21.0 tttp -54.32 -40.43 67.95 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.947 -1.095 . . . . 0.0 109.669 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -58.37 -28.97 65.63 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.24 -0.913 . . . . 0.0 110.276 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -70.93 -54.32 11.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.882 -1.136 . . . . 0.0 109.996 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.6 p90 -99.01 27.77 4.82 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.159 -0.963 . . . . 0.0 111.536 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -62.92 -36.8 84.57 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.699 -1.251 . . . . 0.0 110.381 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -109.29 28.51 8.44 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.192 -0.942 . . . . 0.0 111.019 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.47 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 18.6 t90 -103.42 -49.77 3.62 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.089 -1.007 . . . . 0.0 110.041 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.47 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 1.3 ttm -148.94 -57.51 0.21 Allowed 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.203 -0.935 . . . . 0.0 110.413 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 55.03 -165.51 0.11 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.924 -1.11 . . . . 0.0 110.388 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 53.41 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.036 -1.04 . . . . 0.0 110.371 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 55.49 69.92 0.69 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.979 -1.076 . . . . 0.0 110.338 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.82 69.05 1.07 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.239 -0.913 . . . . 0.0 110.375 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -131.6 33.0 4.07 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.285 -0.884 . . . . 0.0 110.71 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.8 p -103.76 -49.9 3.54 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.097 -1.002 . . . . 0.0 109.389 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.15 -21.11 63.46 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.24 -0.912 . . . . 0.0 111.319 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.718 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -82.8 -40.15 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 120.723 -1.236 . . . . 0.0 109.951 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.58 -40.7 48.8 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -57.07 -33.33 67.16 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.076 -1.015 . . . . 0.0 110.652 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 78.0 m . . . . . 0 N--CA 1.503 2.221 0 O-C-N 120.968 -1.082 . . . . 0.0 110.34 -179.979 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.406 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 9.3 mtmm . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.53 ' HD2' HD13 ' A' ' 13' ' ' LEU . 89.6 t80 -107.08 161.54 14.66 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.225 -0.922 . . . . 0.0 109.992 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -137.76 137.36 38.19 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.114 -0.991 . . . . 0.0 110.222 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 t -120.71 92.84 3.86 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.258 -0.901 . . . . 0.0 110.043 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -52.7 -36.16 56.85 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.041 -1.037 . . . . 0.0 110.424 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.906 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.6 m-85 -60.13 -33.81 72.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.087 -1.008 . . . . 0.0 110.01 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.8 m -94.21 -2.54 52.34 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.101 -0.999 . . . . 0.0 112.129 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.57 40.45 31.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.38 -1.45 . . . . 0.0 110.554 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.8 t -145.93 169.95 17.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.246 -0.909 . . . . 0.0 110.328 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.406 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 23.6 t80 -120.86 140.58 51.58 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.166 -0.959 . . . . 0.0 110.688 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.53 HD13 ' HD2' ' A' ' 4' ' ' PHE . 6.2 mp -97.04 164.42 12.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 t -101.48 -21.83 14.68 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.127 -0.983 . . . . 0.0 112.319 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.461 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.4 m170 -121.83 137.33 54.82 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.596 -1.315 . . . . 0.0 110.198 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -116.09 88.28 2.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.184 -0.947 . . . . 0.0 109.845 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -132.5 178.54 1.71 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.265 -0.897 . . . . 0.0 109.898 -179.617 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -70.88 -28.27 20.09 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.39 1.205 . . . . 0.0 111.285 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.5 m -91.99 -43.17 9.59 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.891 -1.131 . . . . 0.0 110.125 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.461 HG11 ' HB2' ' A' ' 15' ' ' HIS . 87.8 t -58.58 -53.34 48.19 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.091 -1.006 . . . . 0.0 109.905 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 4' ' ' PHE . 34.8 mtp180 -56.98 -50.0 74.01 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.034 -1.041 . . . . 0.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -40.53 96.62 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.122 -0.986 . . . . 0.0 108.692 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.7 m -54.0 -43.02 69.68 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.136 -0.977 . . . . 0.0 108.429 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.3 -38.65 91.98 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 119.565 -0.854 . . . . 0.0 108.822 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -98.57 47.36 0.99 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.206 -0.934 . . . . 0.0 110.466 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -115.37 40.13 2.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.14 -0.975 . . . . 0.0 109.887 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.68 147.86 19.43 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -76.88 -10.42 59.36 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.258 -1.142 . . . . 0.0 111.22 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -88.36 -26.09 22.39 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.652 -1.28 . . . . 0.0 111.079 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.421 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.2 t-80 -49.21 -40.16 32.5 Favored 'General case' 0 N--CA 1.518 2.949 0 O-C-N 120.814 -1.179 . . . . 0.0 110.903 -179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -62.72 -55.62 25.03 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.104 -0.998 . . . . 0.0 109.101 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.86 -38.65 82.73 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.208 -0.932 . . . . 0.0 109.124 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -56.62 -37.28 70.5 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.14 -0.975 . . . . 0.0 110.094 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.906 HG13 ' CD1' ' A' ' 8' ' ' TYR . 47.9 t -55.97 -36.52 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.029 -1.044 . . . . 0.0 109.993 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.4 ttpm? -55.38 -41.1 72.18 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 120.899 -1.125 . . . . 0.0 109.751 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -58.51 -26.05 63.06 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.308 -0.87 . . . . 0.0 110.552 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -73.64 -52.41 13.46 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.819 -1.176 . . . . 0.0 110.438 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.469 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 36.9 p90 -99.08 30.79 3.27 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.036 -1.04 . . . . 0.0 111.517 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -73.98 -41.45 61.9 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.668 -1.27 . . . . 0.0 109.692 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.09 22.85 11.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.314 -0.866 . . . . 0.0 111.117 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.458 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 24.9 t90 -56.41 -48.84 76.11 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.806 -1.184 . . . . 0.0 110.276 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.458 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -139.58 34.74 2.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.933 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 50.19 37.58 15.09 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.926 -1.109 . . . . 0.0 111.02 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -143.65 -172.84 3.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 110.279 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -109.12 114.25 27.81 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -113.92 76.59 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.286 -0.884 . . . . 0.0 110.216 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -108.85 36.37 2.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.168 -0.958 . . . . 0.0 110.371 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.29 -56.08 2.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.204 -0.935 . . . . 0.0 109.424 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.89 64.42 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.196 -0.94 . . . . 0.0 111.254 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.763 HD12 HG11 ' A' ' 34' ' ' VAL . 46.6 mm -69.35 -41.35 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.629 -1.294 . . . . 0.0 109.509 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.08 -39.05 56.21 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.281 -0.887 . . . . 0.0 110.007 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -34.54 72.22 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.158 -0.964 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.5 m . . . . . 0 N--CA 1.505 2.321 0 O-C-N 121.024 -1.048 . . . . 0.0 110.223 179.933 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt . . . . . 0 N--CA 1.503 2.221 0 CA-C-O 121.029 0.442 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.669 ' HD1' HD13 ' A' ' 13' ' ' LEU . 88.2 t80 -116.72 162.16 18.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.993 -1.067 . . . . 0.0 110.353 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -135.9 133.84 38.11 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -113.52 95.53 5.4 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.143 -0.973 . . . . 0.0 110.275 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -52.87 -35.94 58.42 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.065 -1.022 . . . . 0.0 110.34 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.548 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.2 m-85 -60.74 -31.99 71.29 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.136 -0.977 . . . . 0.0 110.11 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.9 m -98.59 -4.96 32.88 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.005 -1.059 . . . . 0.0 112.255 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 t0 54.14 39.59 30.85 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.46 -1.4 . . . . 0.0 110.337 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -142.16 172.96 11.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.195 -0.941 . . . . 0.0 110.032 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -120.03 135.44 54.93 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.262 -0.898 . . . . 0.0 110.594 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.669 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.2 mp -95.43 165.38 12.39 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.166 -0.959 . . . . 0.0 109.442 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.2 t -99.48 -22.16 15.62 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.063 -1.023 . . . . 0.0 112.031 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.775 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.5 m170 -117.17 145.95 43.51 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.721 -1.237 . . . . 0.0 110.282 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -127.81 92.85 3.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 109.569 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.455 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.81 178.93 1.28 Allowed Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.325 -0.86 . . . . 0.0 110.116 -179.529 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -70.53 -26.71 23.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.377 1.198 . . . . 0.0 111.108 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 m -92.66 -41.73 10.02 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.81 -1.181 . . . . 0.0 109.929 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.775 HG11 ' HB2' ' A' ' 15' ' ' HIS . 67.5 t -60.97 -52.49 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.128 -0.983 . . . . 0.0 109.602 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 -56.4 -50.37 71.82 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.053 -1.029 . . . . 0.0 109.558 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.25 -41.28 98.3 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.359 -0.936 . . . . 0.0 108.573 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 57.9 m -54.25 -43.68 71.12 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.081 -1.012 . . . . 0.0 108.445 178.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -62.22 -38.68 90.11 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.407 -0.808 . . . . 0.0 108.832 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -95.84 51.89 1.29 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.155 -0.966 . . . . 0.0 110.336 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.35 37.72 4.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.098 -1.001 . . . . 0.0 110.257 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.79 128.38 3.44 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 ttt-85 -53.83 -28.83 37.98 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.523 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -59.84 -36.35 76.67 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.925 -1.109 . . . . 0.0 110.349 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.599 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -52.16 -40.23 61.13 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.967 -1.083 . . . . 0.0 110.371 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -63.42 -55.05 27.42 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.181 -0.949 . . . . 0.0 109.069 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -60.25 -38.9 84.93 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.245 -0.909 . . . . 0.0 109.098 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -57.12 -38.84 74.02 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.156 -0.965 . . . . 0.0 109.849 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.924 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -60.15 -38.6 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.126 -0.984 . . . . 0.0 109.721 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -56.5 -49.24 75.3 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.988 -1.07 . . . . 0.0 109.445 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.72 -27.58 59.45 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.317 -0.865 . . . . 0.0 110.49 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -74.38 -50.59 17.98 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.904 -1.122 . . . . 0.0 110.548 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.658 ' CE2' HG12 ' A' ' 34' ' ' VAL . 38.5 p90 -99.53 34.43 2.22 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.016 -1.052 . . . . 0.0 111.552 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.4 tp60 -83.85 -40.47 18.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.726 -1.234 . . . . 0.0 109.824 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -115.02 29.43 8.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.264 -0.898 . . . . 0.0 110.83 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CE2' ' HE2' ' A' ' 42' ' ' MET . 12.3 t90 -51.27 -53.68 33.22 Favored 'General case' 0 N--CA 1.513 2.718 0 O-C-N 120.946 -1.096 . . . . 0.0 110.873 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CE2' ' A' ' 41' ' ' TRP . 19.6 mtm -144.7 -71.1 0.28 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.0 110.448 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -172.64 45.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.928 -1.107 . . . . 0.0 111.126 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -165.31 -168.19 1.32 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.124 -0.985 . . . . 0.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -115.47 126.63 54.55 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.208 -0.933 . . . . 0.0 110.074 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -116.34 74.74 0.92 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.03 35.81 3.11 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.047 -1.033 . . . . 0.0 110.395 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -112.09 -53.56 2.7 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.148 -0.97 . . . . 0.0 109.843 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -20.85 63.4 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.188 -0.945 . . . . 0.0 111.545 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.924 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -69.51 -47.61 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.677 -1.265 . . . . 0.0 109.58 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.5 -38.53 77.85 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.121 -0.987 . . . . 0.0 110.245 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -70.87 -35.31 72.32 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.13 -0.981 . . . . 0.0 110.417 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m . . . . . 0 N--CA 1.505 2.317 0 O-C-N 121.004 -1.06 . . . . 0.0 110.174 179.859 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.2 mttm . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE2' ' NH2' ' A' ' 21' ' ' ARG . 37.2 t80 -115.85 156.2 26.53 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.189 -0.944 . . . . 0.0 109.912 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -140.52 140.5 35.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.156 -0.965 . . . . 0.0 110.442 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 t -113.17 98.54 7.2 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.251 -0.905 . . . . 0.0 109.99 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -56.47 -36.55 69.21 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.204 -0.935 . . . . 0.0 110.693 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 24.6 m-85 -62.5 -34.5 76.98 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.047 -1.033 . . . . 0.0 110.064 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.9 m -93.41 -3.18 53.67 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.055 -1.028 . . . . 0.0 112.004 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 53.98 38.73 29.48 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.4 -1.438 . . . . 0.0 110.457 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -134.66 171.68 14.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.265 -0.897 . . . . 0.0 109.86 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.09 120.54 32.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -83.0 162.05 21.56 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.12 -0.987 . . . . 0.0 109.493 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.44 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.4 t -101.09 -31.04 11.26 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.086 -1.009 . . . . 0.0 111.848 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.486 ' HB2' HG11 ' A' ' 20' ' ' VAL . 31.2 m170 -115.23 137.6 51.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.796 -1.19 . . . . 0.0 110.427 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -116.27 89.41 3.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.252 -0.905 . . . . 0.0 109.765 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -131.63 -179.99 1.2 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.857 . . . . 0.0 109.923 -179.568 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.33 -28.92 17.67 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.419 1.221 . . . . 0.0 111.093 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 t -92.27 -44.25 8.85 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.889 -1.132 . . . . 0.0 110.019 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.486 HG11 ' HB2' ' A' ' 15' ' ' HIS . 98.0 t -59.03 -52.23 63.16 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.052 -1.03 . . . . 0.0 109.825 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.449 ' NH2' ' CE2' ' A' ' 4' ' ' PHE . 24.9 mtp85 -58.49 -50.25 74.43 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.031 -1.043 . . . . 0.0 109.552 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -61.27 -39.9 92.12 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.186 -0.946 . . . . 0.0 108.881 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.5 m -54.03 -42.23 68.92 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.149 -0.969 . . . . 0.0 108.681 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.61 -39.58 94.74 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.2 t -93.9 57.3 2.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.304 -0.873 . . . . 0.0 110.084 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.5 m -113.06 37.87 3.01 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.104 -0.998 . . . . 0.0 110.557 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.28 126.55 1.99 Allowed Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.096 -1.201 . . . . 0.0 110.096 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -55.08 -28.19 50.54 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.058 -1.26 . . . . 0.0 110.165 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -57.8 -33.9 69.06 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.888 -1.133 . . . . 0.0 110.394 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.4 t-80 -49.45 -43.94 45.24 Favored 'General case' 0 N--CA 1.515 2.812 0 O-C-N 120.991 -1.068 . . . . 0.0 110.86 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.9 tttt -60.79 -54.08 49.55 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.061 -1.024 . . . . 0.0 109.185 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -60.03 -38.44 82.73 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.211 -0.931 . . . . 0.0 109.088 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -56.51 -37.17 70.06 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.173 -0.954 . . . . 0.0 110.198 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 84.0 t -61.91 -37.34 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 121.082 -1.011 . . . . 0.0 110.066 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.3 mtpt -54.24 -41.78 69.14 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.901 -1.124 . . . . 0.0 109.73 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.91 -28.89 66.62 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.291 178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -71.18 -52.16 20.75 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.924 -1.11 . . . . 0.0 110.285 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.52 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 37.9 p90 -100.09 35.8 1.99 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.079 -1.013 . . . . 0.0 111.263 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -37.9 14.28 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.85 -1.156 . . . . 0.0 110.151 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -112.87 27.82 9.31 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 111.165 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.426 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.0 t90 -70.18 -43.08 71.51 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.029 -1.045 . . . . 0.0 110.019 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.426 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -151.66 36.32 0.57 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.219 -0.926 . . . . 0.0 110.746 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 50.54 38.77 19.47 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.961 -1.087 . . . . 0.0 111.088 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -140.84 -173.94 3.85 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.139 -0.976 . . . . 0.0 110.304 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -112.77 116.69 30.48 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.52 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -115.77 73.47 0.84 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.201 -0.937 . . . . 0.0 110.221 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.74 36.76 2.32 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.082 -1.011 . . . . 0.0 110.205 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.8 p -113.08 -55.63 2.5 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.118 -0.989 . . . . 0.0 109.452 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -21.65 64.33 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.183 -0.948 . . . . 0.0 111.161 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HG11 ' A' ' 34' ' ' VAL . 44.3 mm -66.79 -41.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.618 -1.301 . . . . 0.0 109.219 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -61.17 -41.73 97.3 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.606 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -59.97 -36.49 77.22 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.189 -0.944 . . . . 0.0 110.14 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.505 2.309 0 O-C-N 121.041 -1.037 . . . . 0.0 109.998 179.789 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 mttm . . . . . 0 N--CA 1.506 2.325 0 CA-C-O 121.069 0.462 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.495 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.0 t80 -103.83 161.18 14.17 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.948 -1.095 . . . . 0.0 110.192 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -133.39 137.27 45.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.167 -0.958 . . . . 0.0 110.435 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.6 t -113.69 98.96 7.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.303 -0.873 . . . . 0.0 110.077 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -56.48 -36.83 69.55 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.105 -0.997 . . . . 0.0 110.256 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.8 m-85 -59.7 -33.42 71.58 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.402 ' CB ' HG22 ' A' ' 11' ' ' THR . 39.1 m -95.56 0.15 52.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.016 -1.052 . . . . 0.0 112.112 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 51.92 37.78 21.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.398 -1.439 . . . . 0.0 110.741 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.402 HG22 ' CB ' ' A' ' 9' ' ' CYS . 8.3 t -144.24 171.75 13.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.233 -0.917 . . . . 0.0 109.892 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.38 125.27 47.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 110.206 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.3 mp -74.7 170.29 16.13 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.155 -0.966 . . . . 0.0 109.704 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.444 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.0 t -100.3 -31.8 11.17 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.217 -0.927 . . . . 0.0 111.681 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.494 ' HB2' HG11 ' A' ' 20' ' ' VAL . 30.0 m170 -116.54 142.21 47.17 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.83 -1.169 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -117.79 93.69 4.24 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 109.857 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.05 177.94 1.9 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 110.12 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.96 -31.11 15.69 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.426 1.224 . . . . 0.0 110.954 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -41.77 11.21 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.021 -1.049 . . . . 0.0 110.002 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.494 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.2 t -59.31 -54.29 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 109.911 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 14.8 mtp-105 -56.56 -49.87 73.58 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.102 -0.999 . . . . 0.0 109.907 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -40.47 97.65 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.163 -1.015 . . . . 0.0 108.794 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 55.8 m -54.74 -42.68 71.9 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.08 -1.013 . . . . 0.0 108.423 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -62.36 -35.76 80.12 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.256 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -100.62 42.8 1.09 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.096 -1.003 . . . . 0.0 110.479 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -115.34 38.42 3.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.203 -0.936 . . . . 0.0 110.213 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.75 128.37 3.45 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -54.11 -28.7 41.29 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.227 -1.161 . . . . 0.0 110.359 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -59.24 -35.38 73.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.973 -1.079 . . . . 0.0 110.397 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.558 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.6 t-80 -51.83 -39.04 58.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.91 -1.119 . . . . 0.0 110.473 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -62.19 -53.7 51.55 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.092 -1.005 . . . . 0.0 109.037 179.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -60.63 -39.22 87.42 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.037 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -56.26 -38.74 71.55 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.806 HG11 HD12 ' A' ' 50' ' ' ILE . 79.0 t -58.89 -38.95 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.55 0 O-C-N 121.042 -1.036 . . . . 0.0 109.597 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 1.2 tmmt? -54.47 -39.97 67.98 Favored 'General case' 0 N--CA 1.513 2.705 0 O-C-N 121.028 -1.045 . . . . 0.0 109.618 179.192 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.75 -33.14 69.94 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.37 -53.65 45.25 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.033 -1.042 . . . . 0.0 109.621 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.564 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.9 p90 -100.73 35.29 2.2 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.203 -0.936 . . . . 0.0 110.922 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.45 -35.91 53.48 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.753 -1.217 . . . . 0.0 110.293 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -102.27 21.21 15.39 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.063 -1.023 . . . . 0.0 111.402 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.466 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.2 t90 -106.93 -52.8 2.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.88 -1.138 . . . . 0.0 109.827 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.669 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 2.7 mtm -142.03 54.46 1.47 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.28 -0.888 . . . . 0.0 109.817 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -50.27 -34.99 25.25 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.121 -0.987 . . . . 0.0 111.272 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.2 -61.96 1.94 Allowed 'General case' 0 N--CA 1.513 2.705 0 O-C-N 120.937 -1.102 . . . . 0.0 110.585 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -147.75 96.62 2.7 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.423 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.669 ' HB2' ' HB3' ' A' ' 42' ' ' MET . . . -145.79 71.51 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.229 -0.919 . . . . 0.0 110.486 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 35.15 2.33 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.15 -0.969 . . . . 0.0 110.482 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.02 -52.88 2.71 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.061 -1.024 . . . . 0.0 109.578 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -20.93 64.1 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.262 -0.898 . . . . 0.0 111.334 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.806 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -75.13 -39.99 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 120.622 -1.299 . . . . 0.0 109.847 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -75.76 -40.38 55.47 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.095 -1.003 . . . . 0.0 110.004 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt -57.42 -34.74 69.24 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.164 -0.96 . . . . 0.0 110.635 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.7 m . . . . . 0 N--CA 1.504 2.243 0 O-C-N 121.021 -1.05 . . . . 0.0 110.247 179.858 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.454 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 42.8 mttt . . . . . 0 N--CA 1.494 1.743 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 90.2 t80 -109.65 161.98 14.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.167 -179.774 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -129.36 138.24 51.42 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.113 -0.992 . . . . 0.0 110.37 -179.873 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 47.4 t -117.11 96.77 5.59 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.17 -0.956 . . . . 0.0 109.967 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -51.88 -35.98 47.03 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.021 -1.05 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.708 ' CD1' HG13 ' A' ' 34' ' ' VAL . 76.9 m-85 -62.81 -31.19 72.13 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.186 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.449 ' HB3' HG22 ' A' ' 11' ' ' THR . 36.0 m -98.02 -9.45 26.02 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.008 -1.058 . . . . 0.0 111.965 179.786 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.1 t70 56.34 41.22 29.33 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.382 -1.449 . . . . 0.0 110.014 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.449 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.9 t -146.21 174.26 11.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.281 -0.887 . . . . 0.0 110.191 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.454 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.68 138.84 51.73 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.3 -0.875 . . . . 0.0 110.623 -179.686 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.4 mp -93.79 171.31 8.95 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.137 -0.977 . . . . 0.0 109.735 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -96.67 -30.2 13.38 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.26 -0.9 . . . . 0.0 111.368 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.719 ' HB2' HG11 ' A' ' 20' ' ' VAL . 49.6 m-70 -113.21 148.26 35.84 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.823 -1.173 . . . . 0.0 110.188 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -126.65 96.3 4.62 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.255 -0.903 . . . . 0.0 109.845 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -152.23 178.1 1.68 Allowed Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.234 -0.916 . . . . 0.0 110.456 -179.712 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.0 Cg_endo -70.72 -33.64 12.63 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.296 1.156 . . . . 0.0 110.74 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.7 m -84.65 -37.09 21.47 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.007 -1.058 . . . . 0.0 110.142 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.719 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.9 t -64.51 -45.81 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.084 -1.01 . . . . 0.0 109.438 179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -57.27 -50.77 71.84 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.992 -1.067 . . . . 0.0 109.571 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.65 -41.4 97.46 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.69 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.4 m -54.6 -43.43 72.15 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.18 -0.95 . . . . 0.0 108.612 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.435 ' ND1' HD21 ' A' ' 13' ' ' LEU . 75.4 t60 -61.13 -37.61 83.41 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.452 -0.78 . . . . 0.0 109.109 178.081 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.5 t -94.21 54.65 1.91 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.119 -0.988 . . . . 0.0 110.386 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.12 38.98 3.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.087 -1.008 . . . . 0.0 110.049 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.59 163.43 23.25 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -88.96 -12.49 41.42 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.323 -1.104 . . . . 0.0 110.901 178.909 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.1 mmtm -91.11 -26.64 19.03 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.634 -1.291 . . . . 0.0 111.177 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.549 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.3 t-80 -49.37 -38.66 29.3 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.836 -1.165 . . . . 0.0 110.751 -179.695 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -64.83 -53.44 46.77 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.216 -0.994 . . . . 0.0 108.981 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -61.09 -39.5 90.17 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.181 -0.949 . . . . 0.0 109.028 178.553 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -56.27 -37.98 70.56 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.137 -0.977 . . . . 0.0 110.055 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.708 HG13 ' CD1' ' A' ' 8' ' ' TYR . 64.4 t -59.74 -38.28 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 O-C-N 121.113 -0.992 . . . . 0.0 109.84 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -55.11 -40.69 70.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.912 -1.118 . . . . 0.0 109.782 179.54 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -58.36 -32.14 68.28 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.303 -0.873 . . . . 0.0 110.133 179.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -65.31 -52.84 51.44 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.965 -1.085 . . . . 0.0 110.116 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.599 ' HE2' HG12 ' A' ' 34' ' ' VAL . 47.9 p90 -100.55 35.5 2.12 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.082 -1.011 . . . . 0.0 111.061 179.611 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -81.63 -37.73 27.08 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.727 -1.233 . . . . 0.0 110.297 179.205 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -112.73 21.42 15.57 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.207 -0.933 . . . . 0.0 111.587 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 17.8 t90 -61.08 -46.49 90.45 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.809 -1.182 . . . . 0.0 109.858 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.6 mtm -152.65 36.24 0.5 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.211 -0.93 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.65 46.47 25.67 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.939 -1.101 . . . . 0.0 111.055 179.769 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -146.33 -172.3 3.92 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.107 -0.996 . . . . 0.0 110.374 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -110.86 162.95 14.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.155 -0.966 . . . . 0.0 109.999 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -168.75 77.57 0.12 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.167 -0.958 . . . . 0.0 111.164 -179.748 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -109.85 34.5 3.81 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.058 -1.026 . . . . 0.0 110.433 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.03 -57.71 2.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.182 -0.949 . . . . 0.0 109.101 179.251 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 pp -54.33 -26.34 29.1 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.195 -0.941 . . . . 0.0 111.271 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.638 HD12 HG11 ' A' ' 34' ' ' VAL . 41.5 mm -61.15 -41.51 89.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 120.646 -1.284 . . . . 0.0 109.483 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -36.29 79.53 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.229 -0.919 . . . . 0.0 110.753 -179.62 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.51 -39.61 11.84 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.059 -1.026 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.508 2.427 0 O-C-N 121.154 -0.966 . . . . 0.0 110.091 -179.878 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.445 ' HE3' ' OG1' ' A' ' 14' ' ' THR . 23.8 mttp . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 120.69 0.281 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.445 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 43.1 t80 -110.21 156.04 21.19 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.202 -0.936 . . . . 0.0 109.886 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -138.38 136.8 36.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.608 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 t -110.6 93.45 4.5 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.2 -0.938 . . . . 0.0 110.089 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -52.23 -36.23 51.82 Favored 'General case' 0 N--CA 1.513 2.703 0 O-C-N 121.072 -1.017 . . . . 0.0 110.515 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.863 ' CD1' HG13 ' A' ' 34' ' ' VAL . 87.5 m-85 -60.34 -32.58 71.39 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.133 -0.98 . . . . 0.0 110.025 178.979 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.1 m -97.45 -0.52 46.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.057 -1.027 . . . . 0.0 112.162 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 t70 52.73 38.93 27.62 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.383 -1.448 . . . . 0.0 110.599 -179.709 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -137.56 172.76 12.49 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.286 -0.884 . . . . 0.0 110.021 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.0 120.17 32.57 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.31 -0.869 . . . . 0.0 110.131 -179.759 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -82.17 146.34 29.61 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.193 -0.942 . . . . 0.0 109.612 179.472 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.445 ' OG1' ' HE3' ' A' ' 3' ' ' LYS . 14.1 t -104.06 -20.55 13.81 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.073 -1.017 . . . . 0.0 112.62 -179.35 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.532 ' HB2' HG11 ' A' ' 20' ' ' VAL . 27.7 m-70 -106.16 70.44 0.84 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.587 -1.32 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -61.11 101.78 0.17 Allowed 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.197 -0.939 . . . . 0.0 109.874 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.22 176.63 2.12 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.022 -1.049 . . . . 0.0 110.314 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.83 -31.86 15.07 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.519 1.273 . . . . 0.0 110.89 179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -91.1 -39.78 11.97 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.953 -1.092 . . . . 0.0 110.222 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.0 t -60.01 -49.18 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.568 0 O-C-N 121.155 -0.966 . . . . 0.0 109.663 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.445 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 16.5 mtp180 -58.56 -51.73 68.64 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.079 -1.013 . . . . 0.0 109.609 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -40.6 97.6 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.262 -0.975 . . . . 0.0 108.818 179.014 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 93.8 m -56.0 -42.88 77.08 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.077 -1.014 . . . . 0.0 108.37 178.316 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -63.53 -36.38 83.59 Favored 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.152 178.13 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 t -100.16 43.85 1.04 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.138 -0.976 . . . . 0.0 110.473 -179.671 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.77 38.49 3.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.182 -0.949 . . . . 0.0 110.138 179.773 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.95 127.32 2.97 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -54.63 -28.33 46.07 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.087 -1.243 . . . . 0.0 110.226 178.955 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -58.92 -33.63 70.79 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.991 -1.068 . . . . 0.0 110.681 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.606 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.84 -38.44 49.01 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.876 -1.14 . . . . 0.0 110.705 -179.41 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -63.65 -53.03 57.83 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.135 -0.978 . . . . 0.0 108.942 179.289 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.98 -39.89 91.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.239 -0.913 . . . . 0.0 108.944 178.642 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -56.11 -38.12 70.34 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.211 -0.931 . . . . 0.0 110.083 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.863 HG13 ' CD1' ' A' ' 8' ' ' TYR . 79.3 t -57.58 -36.8 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.069 -1.019 . . . . 0.0 110.032 179.626 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.9 tttt -53.02 -40.96 64.24 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.924 -1.11 . . . . 0.0 109.892 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -58.79 -29.67 67.0 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.223 178.912 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -68.55 -52.4 32.28 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.976 -1.078 . . . . 0.0 110.257 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 43.4 p90 -100.09 33.58 2.58 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.004 -1.06 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.46 -64.71 1.11 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.791 -1.193 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' CG ' ' A' ' 43' ' ' GLU . 1.3 tptm -64.42 -34.64 78.65 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.304 -0.873 . . . . 0.0 110.086 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 8.5 t90 -52.52 -48.07 66.28 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.041 -1.037 . . . . 0.0 111.278 -179.453 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -105.82 -45.22 4.44 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.02 -1.05 . . . . 0.0 111.26 -179.308 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.406 ' CG ' ' HA ' ' A' ' 40' ' ' LYS . 40.1 mm-40 53.4 37.63 25.97 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.974 -1.079 . . . . 0.0 110.704 -179.504 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -160.75 -66.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.222 -0.924 . . . . 0.0 110.83 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -158.54 104.87 1.82 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.264 -0.897 . . . . 0.0 110.809 -179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -145.79 70.67 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.24 -0.912 . . . . 0.0 110.326 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -120.46 36.76 4.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.373 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.7 -53.71 2.67 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.195 -0.941 . . . . 0.0 109.654 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.35 -21.05 63.66 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.196 -0.94 . . . . 0.0 111.464 179.537 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 48.5 mm -72.61 -40.1 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 120.626 -1.296 . . . . 0.0 109.777 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -65.67 -40.15 92.11 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.124 -0.985 . . . . 0.0 109.971 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -64.18 -35.2 80.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.136 -0.977 . . . . 0.0 110.502 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.7 m . . . . . 0 N--CA 1.504 2.251 0 O-C-N 121.008 -1.057 . . . . 0.0 110.131 179.812 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.7 mtmm . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 120.691 0.281 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' HD13 ' A' ' 13' ' ' LEU . 42.3 t80 -114.75 156.43 24.84 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.965 . . . . 0.0 109.921 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -136.08 135.94 39.77 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.104 -0.997 . . . . 0.0 110.561 -179.733 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 t -111.63 93.82 4.66 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.224 -0.922 . . . . 0.0 110.202 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -52.64 -35.85 55.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.115 -0.991 . . . . 0.0 110.379 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.851 ' CD1' HG13 ' A' ' 34' ' ' VAL . 79.7 m-85 -60.86 -32.85 72.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.176 -0.952 . . . . 0.0 110.098 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.3 m -96.95 -0.71 47.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.991 -1.068 . . . . 0.0 112.084 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t70 53.07 38.64 27.88 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.367 -1.458 . . . . 0.0 110.656 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -139.43 171.68 13.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.147 -0.971 . . . . 0.0 110.036 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.17 120.39 34.08 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.184 -0.947 . . . . 0.0 110.032 -179.66 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.519 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.6 mp -78.25 166.14 23.06 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.161 -0.962 . . . . 0.0 109.558 179.43 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.414 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.0 t -102.22 -30.43 11.11 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.085 -1.009 . . . . 0.0 112.013 -179.367 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CG ' HG23 ' A' ' 14' ' ' THR . 32.1 m170 -113.72 139.78 48.8 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.682 -1.261 . . . . 0.0 110.5 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -116.13 94.98 4.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.359 -0.838 . . . . 0.0 109.765 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.24 176.53 2.25 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.234 -0.916 . . . . 0.0 110.169 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.49 -30.33 23.71 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 O-C-N 123.386 1.203 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.5 t -88.01 -41.47 13.09 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.931 -1.105 . . . . 0.0 109.974 179.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.3 t -59.82 -50.47 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.187 -0.946 . . . . 0.0 109.787 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' NH1' ' CE1' ' A' ' 4' ' ' PHE . 19.4 mtt180 -58.06 -51.73 68.46 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.053 -1.029 . . . . 0.0 109.611 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -60.85 -40.58 93.43 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.958 178.848 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.0 m -55.36 -43.04 74.7 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 121.145 -0.972 . . . . 0.0 108.507 178.316 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -64.37 -39.71 94.4 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.425 -0.797 . . . . 0.0 108.95 178.148 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.17 56.53 2.54 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.145 -0.972 . . . . 0.0 110.274 -179.775 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 37.86 3.57 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.049 -1.032 . . . . 0.0 110.403 179.815 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.49 125.2 2.01 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -54.71 -27.96 44.5 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.174 -1.192 . . . . 0.0 110.359 179.051 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 tptt -60.62 -31.78 70.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.933 -1.104 . . . . 0.0 110.764 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.597 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.2 t-80 -49.83 -42.59 47.61 Favored 'General case' 0 N--CA 1.517 2.892 0 O-C-N 120.884 -1.135 . . . . 0.0 110.865 -179.492 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -62.7 -52.56 62.81 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.116 -0.99 . . . . 0.0 109.109 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -61.4 -40.23 93.62 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.194 -0.941 . . . . 0.0 108.894 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -56.27 -37.94 70.5 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.324 -0.86 . . . . 0.0 109.914 179.083 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.851 HG13 ' CD1' ' A' ' 8' ' ' TYR . 78.2 t -55.95 -34.52 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.602 0 O-C-N 121.05 -1.031 . . . . 0.0 110.141 179.632 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.462 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -54.82 -42.92 72.47 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.858 -1.151 . . . . 0.0 109.763 179.421 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.39 -27.97 64.76 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 178.904 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.03 -52.08 26.98 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.891 -1.131 . . . . 0.0 110.325 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.466 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 40.6 p90 -99.69 32.53 2.82 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.991 -1.068 . . . . 0.0 111.404 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -82.49 -38.46 23.85 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.728 -1.233 . . . . 0.0 109.805 178.68 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.5 tttp -109.28 31.35 5.81 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.234 -0.916 . . . . 0.0 110.548 179.261 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 7.8 t90 -85.84 -40.49 15.92 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.062 -1.024 . . . . 0.0 110.134 -179.904 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.544 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 14.8 ptp -176.59 -43.69 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.139 -0.976 . . . . 0.0 112.038 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -116.62 176.8 4.95 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.677 -1.264 . . . . 0.0 110.452 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -101.12 -42.72 6.26 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.277 -0.89 . . . . 0.0 110.594 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -105.04 83.49 1.99 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.039 -1.038 . . . . 0.0 110.198 179.896 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.466 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -117.13 75.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.204 -0.935 . . . . 0.0 110.107 -179.99 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.44 35.63 3.11 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 110.461 179.598 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -110.29 -54.31 2.59 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.126 -0.984 . . . . 0.0 109.401 179.222 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -20.96 64.21 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.203 -0.936 . . . . 0.0 111.297 179.18 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.418 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.6 mm -71.81 -46.32 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.646 -1.284 . . . . 0.0 109.446 179.615 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.56 -38.47 84.65 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.236 -0.915 . . . . 0.0 110.028 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -35.06 64.89 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.045 -1.034 . . . . 0.0 110.659 -179.855 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 N--CA 1.504 2.239 0 O-C-N 121.041 -1.037 . . . . 0.0 110.303 179.919 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 25.4 mttt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.624 ' HD1' HD13 ' A' ' 13' ' ' LEU . 69.8 t80 -112.78 162.01 16.25 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -131.08 136.74 48.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.466 -179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.3 t -116.16 98.37 6.58 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.264 -0.898 . . . . 0.0 109.826 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -51.82 -35.92 46.05 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.015 -1.053 . . . . 0.0 110.782 -179.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.567 ' CD2' HG13 ' A' ' 34' ' ' VAL . 78.9 m-85 -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.088 -1.008 . . . . 0.0 110.291 179.4 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.0 m -97.29 -10.49 25.6 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.097 -1.002 . . . . 0.0 111.881 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 55.91 40.78 30.48 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.462 -1.399 . . . . 0.0 110.172 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -142.11 170.72 15.19 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.22 -0.925 . . . . 0.0 109.984 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.7 t80 -117.17 125.21 50.84 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.265 -0.897 . . . . 0.0 110.398 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.624 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.3 mp -80.61 170.68 16.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.203 -0.936 . . . . 0.0 109.72 179.67 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.424 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.1 t -96.91 -30.49 13.09 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.204 -0.935 . . . . 0.0 111.334 -179.793 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 32.6 m170 -113.69 146.44 39.82 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.875 -1.141 . . . . 0.0 110.205 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -125.95 93.52 3.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.123 -0.985 . . . . 0.0 109.727 179.81 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -146.73 179.75 1.11 Allowed Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.511 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -71.75 -32.12 12.1 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.341 1.18 . . . . 0.0 110.935 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -39.21 17.03 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.949 -1.094 . . . . 0.0 109.95 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 61.3 t -64.61 -47.48 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.12 -0.987 . . . . 0.0 109.609 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -57.62 -52.58 64.82 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.038 -1.039 . . . . 0.0 109.714 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -60.03 -39.84 87.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.128 -0.982 . . . . 0.0 108.943 178.882 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.3 m -55.08 -43.78 74.26 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.051 -1.031 . . . . 0.0 108.4 178.267 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.407 ' ND1' HD21 ' A' ' 13' ' ' LEU . 71.2 t60 -62.25 -37.46 85.53 Favored 'General case' 0 N--CA 1.504 2.252 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.84 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.34 48.46 0.99 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.216 -0.927 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.05 38.27 3.23 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.087 -1.008 . . . . 0.0 110.245 179.805 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.89 127.66 2.86 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -54.21 -28.52 41.52 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.106 -1.232 . . . . 0.0 110.32 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -58.68 -35.5 72.7 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.058 -1.026 . . . . 0.0 110.462 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.577 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.0 t-80 -51.74 -40.7 60.7 Favored 'General case' 0 N--CA 1.515 2.788 0 O-C-N 121.03 -1.044 . . . . 0.0 110.427 -179.709 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -63.06 -52.22 63.61 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.123 -0.986 . . . . 0.0 108.819 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.65 -39.92 93.06 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.185 -0.947 . . . . 0.0 108.868 178.507 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -56.21 -38.58 71.22 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.961 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.666 HG12 ' HE2' ' A' ' 38' ' ' TYR . 70.6 t -58.56 -38.89 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.125 -0.984 . . . . 0.0 109.712 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.6 mtmp? -57.29 -44.83 84.37 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.059 -1.025 . . . . 0.0 109.261 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.7 -31.81 64.85 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.339 -0.851 . . . . 0.0 110.051 178.795 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -64.07 -53.16 54.19 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.98 -1.075 . . . . 0.0 109.769 179.729 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.666 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -99.69 28.03 4.98 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.111 -0.993 . . . . 0.0 111.602 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -56.45 -41.0 75.74 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.637 -1.29 . . . . 0.0 110.064 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -126.94 28.42 5.81 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.248 -0.908 . . . . 0.0 111.199 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.1 t90 -52.59 -36.28 55.82 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.903 -1.123 . . . . 0.0 110.805 -179.72 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.464 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -138.35 -67.71 0.46 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.143 -0.973 . . . . 0.0 110.398 179.908 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -170.93 -52.01 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.092 -1.005 . . . . 0.0 111.138 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.08 -168.83 2.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.224 -0.922 . . . . 0.0 109.771 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -95.62 144.51 26.0 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.088 -1.008 . . . . 0.0 110.25 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HB1' HD21 ' A' ' 49' ' ' LEU . . . -123.64 84.52 2.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.224 -0.923 . . . . 0.0 110.333 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -105.49 34.39 3.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 110.598 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.8 p -112.5 -55.04 2.56 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.112 -0.993 . . . . 0.0 109.314 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.478 HD21 ' HB1' ' A' ' 46' ' ' ALA . 0.6 OUTLIER -60.06 -21.62 61.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.3 -0.875 . . . . 0.0 111.403 179.225 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG11 ' A' ' 34' ' ' VAL . 46.4 mm -68.93 -48.38 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.58 -1.325 . . . . 0.0 109.395 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.99 -39.18 80.99 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.165 -0.96 . . . . 0.0 110.191 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -56.48 -36.61 69.31 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.211 -0.931 . . . . 0.0 110.72 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.504 2.233 0 O-C-N 121.096 -1.002 . . . . 0.0 110.406 179.971 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.3 t80 -110.85 161.5 15.74 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.14 -0.975 . . . . 0.0 110.188 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -137.4 133.26 34.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.914 . . . . 0.0 110.194 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.1 t -113.91 94.64 4.92 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.118 -0.989 . . . . 0.0 110.173 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -52.85 -35.9 58.12 Favored 'General case' 0 N--CA 1.513 2.689 0 O-C-N 121.025 -1.047 . . . . 0.0 110.478 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.0 m-85 -60.59 -32.91 71.99 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.159 -0.963 . . . . 0.0 110.106 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.9 m -96.63 -3.89 42.0 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.063 -1.023 . . . . 0.0 112.181 -179.908 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 t70 53.69 39.12 29.8 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.383 -1.448 . . . . 0.0 110.458 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -141.98 170.72 15.18 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.217 -0.927 . . . . 0.0 109.914 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -119.49 136.74 54.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.779 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.2 mp -96.26 161.88 13.76 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.267 -0.895 . . . . 0.0 109.578 179.322 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.46 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.9 t -98.57 -21.81 16.29 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.076 -1.015 . . . . 0.0 111.81 -179.691 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 51.6 m-70 -114.37 143.99 44.0 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.709 -1.245 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -125.67 92.54 3.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 109.715 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -147.43 177.9 1.62 Allowed Pre-proline 0 N--CA 1.496 1.868 0 O-C-N 121.279 -0.888 . . . . 0.0 110.214 -179.518 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.51 -33.26 14.04 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.395 1.208 . . . . 0.0 110.775 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.5 m -84.2 -39.2 19.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.956 -1.09 . . . . 0.0 110.035 179.569 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 70.1 t -64.38 -45.93 94.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.061 -1.024 . . . . 0.0 109.451 179.75 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 -59.71 -52.28 66.17 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.175 -0.953 . . . . 0.0 109.351 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -59.55 -39.67 84.74 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.137 -0.977 . . . . 0.0 108.908 178.865 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -55.39 -43.68 75.41 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.143 -0.973 . . . . 0.0 108.406 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.49 -40.4 96.99 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.936 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 t -92.5 56.95 2.84 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.285 -0.884 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.36 37.9 3.4 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.086 -1.009 . . . . 0.0 110.378 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.43 123.68 1.6 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -29.65 29.7 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.104 -1.233 . . . . 0.0 110.192 178.929 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 6.2 ptpt -57.12 -32.87 66.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.724 179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.613 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.4 t-80 -49.82 -41.76 45.54 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.978 -1.076 . . . . 0.0 110.737 -179.612 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -62.68 -54.45 39.11 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.16 -0.962 . . . . 0.0 108.986 179.167 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.43 -39.67 88.27 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.108 178.713 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -56.76 -37.6 71.27 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.227 -0.921 . . . . 0.0 110.018 179.118 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.948 HG11 HD12 ' A' ' 50' ' ' ILE . 73.5 t -56.67 -35.95 47.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.041 -1.037 . . . . 0.0 110.268 179.71 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.7 ttmm -57.35 -44.89 84.69 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.86 -1.15 . . . . 0.0 109.677 179.357 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.29 -25.13 63.86 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.479 178.966 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.41 -50.44 15.86 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.832 -1.167 . . . . 0.0 110.676 -179.723 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 34.5 p90 -99.49 32.96 2.61 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.976 -1.077 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -83.97 -38.43 20.99 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.715 -1.24 . . . . 0.0 109.927 178.795 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -112.01 32.21 5.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.117 -0.989 . . . . 0.0 110.583 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.6 t90 -90.82 -39.2 12.49 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.152 -0.968 . . . . 0.0 110.094 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -150.58 -63.26 0.2 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.224 -0.923 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -140.47 -171.67 3.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.56 39.3 2.13 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.173 -0.955 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -147.37 74.71 1.34 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.229 -0.92 . . . . 0.0 110.241 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -142.74 72.49 1.37 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.248 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 36.36 3.89 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.284 -0.885 . . . . 0.0 110.322 179.643 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -111.04 -54.9 2.56 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -20.17 65.29 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.24 -0.912 . . . . 0.0 111.285 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.948 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -72.79 -52.95 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 O-C-N 120.719 -1.238 . . . . 0.0 109.705 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.63 -40.25 86.99 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.197 -0.939 . . . . 0.0 110.075 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 tptp -56.21 -32.23 64.21 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.075 -1.015 . . . . 0.0 110.802 -179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 m . . . . . 0 N--CA 1.507 2.395 0 O-C-N 120.961 -1.087 . . . . 0.0 110.816 -179.883 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.7 mttt . . . . . 0 N--CA 1.495 1.796 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -115.48 162.12 17.63 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.186 -0.946 . . . . 0.0 110.101 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -140.12 132.51 28.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.157 -0.965 . . . . 0.0 110.284 -179.621 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.4 t -113.66 90.09 3.25 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.21 -0.932 . . . . 0.0 109.967 179.403 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -51.65 -35.75 43.37 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.029 -1.044 . . . . 0.0 110.348 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 87.1 m-85 -59.56 -31.65 69.63 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.978 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.8 m -98.24 0.02 44.92 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.016 -1.053 . . . . 0.0 112.258 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t0 52.63 38.9 27.2 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.381 -1.45 . . . . 0.0 110.666 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -143.21 172.15 13.12 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.32 -0.862 . . . . 0.0 110.029 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -123.6 139.73 53.71 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.287 -0.883 . . . . 0.0 110.871 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -100.44 163.09 12.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.264 -0.897 . . . . 0.0 109.36 179.314 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.503 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.72 -30.91 11.46 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.064 -1.022 . . . . 0.0 111.849 -179.247 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' A' ' 14' ' ' THR . 47.9 m-70 -113.02 134.89 54.31 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.792 -1.193 . . . . 0.0 110.3 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -115.39 82.43 1.75 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.178 -0.951 . . . . 0.0 109.776 179.731 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -126.32 -179.93 1.03 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.288 -0.882 . . . . 0.0 110.008 -179.658 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.24 -29.37 17.32 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.364 1.192 . . . . 0.0 111.099 179.979 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 t -88.84 -46.31 9.04 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.867 -1.145 . . . . 0.0 110.033 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.46 HG11 ' HB2' ' A' ' 15' ' ' HIS . 91.2 t -58.55 -55.09 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.133 -0.98 . . . . 0.0 109.98 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -55.55 -50.83 68.99 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.067 -1.021 . . . . 0.0 109.85 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.5 mttm -61.88 -39.85 93.34 Favored 'General case' 0 N--CA 1.506 2.36 0 C-N-CA 119.298 -0.961 . . . . 0.0 108.867 178.781 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 74.0 m -54.88 -42.95 72.71 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.11 -0.994 . . . . 0.0 108.433 178.267 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -62.25 -39.51 93.1 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.887 178.119 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -94.7 53.22 1.6 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.287 -0.883 . . . . 0.0 110.417 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.34 39.83 3.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.088 -1.008 . . . . 0.0 109.992 179.648 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.13 154.07 21.44 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -83.83 -10.26 58.17 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.327 -1.102 . . . . 0.0 111.074 178.827 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttm -90.51 -24.36 20.67 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.696 -1.253 . . . . 0.0 111.115 179.471 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.0 t-80 -48.63 -38.75 21.86 Favored 'General case' 0 N--CA 1.517 2.911 0 O-C-N 120.767 -1.208 . . . . 0.0 110.853 -179.716 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -65.53 -53.78 37.36 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.275 -0.97 . . . . 0.0 108.83 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.29 -39.33 90.05 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.17 -0.956 . . . . 0.0 108.981 178.615 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -56.66 -37.16 70.43 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.21 -0.931 . . . . 0.0 110.167 179.193 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 58.0 t -58.62 -43.4 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.024 -1.047 . . . . 0.0 109.726 179.837 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 24.1 ttmt -62.32 -43.25 99.25 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.986 179.086 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -60.61 -24.43 65.49 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.295 178.625 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -75.81 -51.83 11.73 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.764 -1.21 . . . . 0.0 110.452 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.516 ' HE2' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -98.94 28.99 4.02 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.002 -1.061 . . . . 0.0 111.643 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.08 -41.41 97.32 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.66 -1.275 . . . . 0.0 109.664 179.299 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -117.49 25.91 10.09 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.362 -0.836 . . . . 0.0 111.162 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.484 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.2 t90 -56.87 -39.25 73.98 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.963 -1.085 . . . . 0.0 110.344 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.484 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.2 ttm -147.03 33.55 0.91 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 49.79 37.59 13.64 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.955 -1.091 . . . . 0.0 111.258 179.692 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -145.01 -171.64 3.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.157 -0.964 . . . . 0.0 110.408 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -111.02 128.42 55.85 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.186 -0.946 . . . . 0.0 110.057 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.4 75.82 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.286 -0.884 . . . . 0.0 110.314 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.99 35.64 3.17 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.195 -0.94 . . . . 0.0 110.319 179.411 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.9 t -111.26 -55.58 2.48 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.151 -0.968 . . . . 0.0 109.294 179.277 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -20.84 65.53 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.229 -0.92 . . . . 0.0 111.118 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.796 HD12 HG11 ' A' ' 34' ' ' VAL . 47.0 mm -71.91 -49.09 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.668 -1.27 . . . . 0.0 109.546 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -41.37 80.57 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.123 -0.986 . . . . 0.0 109.939 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.4 mmtm -59.95 -34.98 73.98 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.159 -0.963 . . . . 0.0 110.478 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.8 m . . . . . 0 N--CA 1.503 2.206 0 O-C-N 120.996 -1.065 . . . . 0.0 110.518 -179.937 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.637 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.0 t80 -112.16 162.55 15.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.161 -0.962 . . . . 0.0 110.466 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -132.22 139.65 48.39 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.15 -0.969 . . . . 0.0 110.223 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -121.06 96.86 5.26 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.08 -1.013 . . . . 0.0 110.098 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -53.53 -36.4 61.74 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.061 -1.024 . . . . 0.0 110.407 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.807 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.8 m-85 -60.7 -32.02 71.27 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.095 -1.003 . . . . 0.0 110.125 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.9 m -96.82 -6.07 36.88 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.966 -1.084 . . . . 0.0 112.126 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 54.17 39.45 30.73 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.453 -1.405 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.4 t -144.71 169.92 17.08 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.267 -0.895 . . . . 0.0 110.021 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -115.84 130.94 57.04 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.205 -0.934 . . . . 0.0 110.425 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.637 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.5 mp -84.88 169.3 14.25 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.183 -0.948 . . . . 0.0 109.756 179.615 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.432 HG23 ' ND1' ' A' ' 15' ' ' HIS . 13.7 t -100.81 -21.83 15.03 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.195 -0.941 . . . . 0.0 112.108 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.564 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.1 m170 -126.26 143.44 51.15 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.616 -1.303 . . . . 0.0 110.315 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -120.79 92.04 3.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -139.06 178.21 1.74 Allowed Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.227 -0.921 . . . . 0.0 109.985 -179.55 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.66 -29.43 19.58 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.394 1.207 . . . . 0.0 111.114 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -90.96 -41.61 11.03 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.899 -1.126 . . . . 0.0 110.033 179.612 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.564 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.7 t -60.11 -49.82 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.807 179.823 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -57.96 -51.67 68.68 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.066 -1.021 . . . . 0.0 109.661 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -61.81 -40.37 95.03 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.16 -0.962 . . . . 0.0 108.799 178.851 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -55.16 -43.1 73.95 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.142 -0.974 . . . . 0.0 108.382 178.237 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -63.07 -38.97 93.31 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.927 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.66 50.97 1.14 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.22 -0.925 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.7 m -117.79 37.73 3.85 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.096 -1.002 . . . . 0.0 110.313 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.77 126.95 2.77 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.2 ttt85 -54.4 -28.44 43.61 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.235 -1.156 . . . . 0.0 110.319 179.078 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -59.2 -34.76 72.54 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.96 -1.088 . . . . 0.0 110.35 179.861 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.704 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.1 t-80 -51.14 -40.19 58.0 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.912 -1.117 . . . . 0.0 110.514 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -63.33 -54.68 33.24 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.263 -0.975 . . . . 0.0 109.025 179.182 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.69 -39.52 88.81 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 178.68 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -57.01 -37.76 72.14 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.199 -0.938 . . . . 0.0 110.035 179.18 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.807 HG13 ' CD1' ' A' ' 8' ' ' TYR . 85.8 t -56.5 -34.04 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 O-C-N 121.093 -1.004 . . . . 0.0 110.253 179.75 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.8 tttp -52.85 -40.95 63.82 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.855 -1.153 . . . . 0.0 110.029 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -59.33 -29.6 67.76 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.261 178.868 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -68.05 -51.55 45.4 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.94 -1.1 . . . . 0.0 110.327 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.681 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 45.0 p90 -100.16 35.62 2.04 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.068 -1.02 . . . . 0.0 111.157 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -87.95 -37.91 16.01 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.863 -1.148 . . . . 0.0 110.001 178.694 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -110.79 29.63 7.57 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.273 -0.892 . . . . 0.0 110.865 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.428 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 26.5 t90 -93.98 -42.74 8.89 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.02 -1.05 . . . . 0.0 110.01 179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.428 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -145.59 -60.28 0.34 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.206 -0.934 . . . . 0.0 110.382 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -146.08 -171.17 3.66 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.128 -0.983 . . . . 0.0 110.266 -179.919 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -106.59 39.57 1.81 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.122 -0.986 . . . . 0.0 110.137 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -150.75 76.14 1.24 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.259 -0.9 . . . . 0.0 110.405 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.681 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -141.15 73.66 1.43 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.17 -0.956 . . . . 0.0 110.297 -179.902 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.22 35.49 4.63 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.597 179.673 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 5.5 p -110.58 -54.18 2.61 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.068 -1.02 . . . . 0.0 109.463 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -61.47 -20.9 63.66 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.183 -0.948 . . . . 0.0 111.377 179.28 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.55 HD12 HG11 ' A' ' 34' ' ' VAL . 47.3 mm -71.56 -42.64 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 120.719 -1.238 . . . . 0.0 109.509 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.22 -39.57 92.95 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.161 -0.962 . . . . 0.0 110.053 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -64.36 -34.83 79.07 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.08 -1.013 . . . . 0.0 110.626 -179.873 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m . . . . . 0 N--CA 1.505 2.28 0 O-C-N 120.993 -1.067 . . . . 0.0 110.447 179.975 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt . . . . . 0 N--CA 1.505 2.309 0 CA-C-O 121.04 0.447 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.402 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 39.3 t80 -112.26 151.9 29.1 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.041 -1.037 . . . . 0.0 110.19 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -125.93 137.18 53.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.19 -0.944 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 36.2 t -114.77 92.37 3.92 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.213 -0.929 . . . . 0.0 110.061 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -51.45 -35.94 41.87 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.093 -1.004 . . . . 0.0 110.361 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.675 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -60.0 -31.08 69.59 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.138 -0.976 . . . . 0.0 110.008 178.882 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' HG22 ' A' ' 11' ' ' THR . 32.1 m -98.9 0.84 44.96 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.002 -1.061 . . . . 0.0 112.237 179.916 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.1 38.34 23.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.315 -1.491 . . . . 0.0 110.679 -179.662 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.423 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.0 t -146.61 171.68 14.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.987 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.401 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER -125.94 126.5 44.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.251 -179.73 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -77.32 167.43 21.72 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.173 -0.955 . . . . 0.0 109.885 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.1 t -100.15 -30.49 11.9 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.137 -0.977 . . . . 0.0 111.635 -179.702 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.472 ' HB2' HG11 ' A' ' 20' ' ' VAL . 35.6 m-70 -110.4 144.63 38.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.772 -1.205 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -121.87 95.31 4.61 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.77 177.93 1.67 Allowed Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.192 -0.943 . . . . 0.0 110.158 -179.578 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.2 Cg_endo -71.16 -32.41 13.09 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.396 1.209 . . . . 0.0 110.916 179.859 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 t -87.4 -40.02 14.75 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.974 -1.079 . . . . 0.0 110.0 179.588 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.472 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.1 t -61.11 -45.62 98.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.131 -0.981 . . . . 0.0 109.612 179.724 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 46.8 mtt180 -60.0 -53.79 53.71 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.096 -1.002 . . . . 0.0 109.483 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -59.79 -39.51 85.2 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.142 -0.974 . . . . 0.0 109.026 178.947 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.7 m -55.31 -42.79 74.19 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.075 -1.016 . . . . 0.0 108.517 178.359 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -63.12 -37.05 85.67 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.153 178.116 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 49.01 1.02 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.116 -0.99 . . . . 0.0 110.509 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 m -115.51 38.6 3.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.104 -0.997 . . . . 0.0 110.182 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.2 126.03 2.4 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.8 ttm-85 -53.31 -29.18 32.28 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.115 -1.226 . . . . 0.0 110.398 179.046 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 -33.92 70.14 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.042 -1.036 . . . . 0.0 110.654 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -51.34 -38.92 55.67 Favored 'General case' 0 N--CA 1.516 2.84 0 O-C-N 120.908 -1.12 . . . . 0.0 110.603 -179.591 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -62.99 -53.85 47.53 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.089 179.265 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.49 -39.26 87.05 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.22 -0.925 . . . . 0.0 108.956 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.52 -39.07 70.06 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.212 -0.93 . . . . 0.0 110.083 179.208 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.675 HG13 ' CD2' ' A' ' 8' ' ' TYR . 76.4 t -60.17 -36.44 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.071 -1.018 . . . . 0.0 109.761 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 61.2 tttp -52.75 -40.35 63.01 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.974 -1.078 . . . . 0.0 109.993 179.565 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.87 -33.44 68.7 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 179.12 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -63.94 -52.63 58.88 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.082 -1.011 . . . . 0.0 109.961 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.588 ' HE2' HG12 ' A' ' 34' ' ' VAL . 48.8 p90 -100.34 33.72 2.59 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.142 -0.973 . . . . 0.0 111.109 179.631 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -81.39 -38.81 25.96 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.781 -1.199 . . . . 0.0 110.181 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -117.08 21.21 13.37 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.244 -0.91 . . . . 0.0 111.636 179.791 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.6 t90 -59.85 -40.0 87.09 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.827 -1.171 . . . . 0.0 110.038 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.507 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 4.6 mtm -149.9 37.99 0.73 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -0.968 . . . . 0.0 110.59 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.16 38.18 20.32 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.0 -1.063 . . . . 0.0 110.975 179.924 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -145.99 -172.98 4.04 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.252 -0.905 . . . . 0.0 110.418 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -113.58 125.12 53.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 110.121 179.873 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -124.29 76.17 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.208 -0.932 . . . . 0.0 110.311 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.44 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -106.74 36.15 2.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.178 -0.951 . . . . 0.0 110.379 179.479 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -113.12 -54.9 2.58 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.214 -0.928 . . . . 0.0 109.571 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -22.01 61.55 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.186 -0.946 . . . . 0.0 111.463 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.561 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -68.34 -47.13 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 120.606 -1.309 . . . . 0.0 109.371 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -57.54 -36.7 71.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.155 -0.966 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -77.18 -34.81 56.24 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.016 -1.053 . . . . 0.0 110.643 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.4 m . . . . . 0 N--CA 1.506 2.368 0 O-C-N 121.034 -1.041 . . . . 0.0 110.26 179.977 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 30.3 mttp . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.614 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.4 t80 -109.62 161.86 14.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.219 -0.926 . . . . 0.0 110.118 179.991 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -136.51 135.33 38.44 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.141 -0.974 . . . . 0.0 110.24 -179.611 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -116.84 92.72 3.94 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.146 -0.971 . . . . 0.0 110.001 179.463 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -51.78 -35.77 45.05 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.014 -1.054 . . . . 0.0 110.408 179.805 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.5 m-85 -60.04 -32.95 71.39 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.133 -0.979 . . . . 0.0 110.004 179.008 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 m -95.54 -2.83 47.71 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.051 -1.031 . . . . 0.0 112.254 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.23 39.71 30.12 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.324 -1.485 . . . . 0.0 110.399 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -145.66 171.4 14.77 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.359 -0.838 . . . . 0.0 110.191 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 14.0 t80 -118.41 140.37 49.96 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.246 -0.909 . . . . 0.0 110.565 -179.517 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.614 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.3 mp -96.72 167.19 11.27 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.204 -0.935 . . . . 0.0 109.623 179.517 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.41 HG23 ' CG ' ' A' ' 15' ' ' HIS . 13.9 t -100.05 -29.81 12.32 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.847 -179.488 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.694 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.4 m170 -113.0 147.58 36.87 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.742 -1.223 . . . . 0.0 110.379 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -126.55 93.93 3.92 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.238 -0.914 . . . . 0.0 109.789 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -146.61 177.83 1.64 Allowed Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.194 -0.941 . . . . 0.0 110.277 -179.598 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -69.95 -27.66 25.31 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.383 1.202 . . . . 0.0 111.154 179.824 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.75 -39.0 12.04 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.92 -1.113 . . . . 0.0 110.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.694 HG11 ' HB2' ' A' ' 15' ' ' HIS . 80.8 t -62.93 -49.26 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.001 -1.062 . . . . 0.0 109.562 179.809 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -57.55 -48.43 79.33 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.141 -0.975 . . . . 0.0 109.635 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.0 -41.26 97.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.196 -0.94 . . . . 0.0 108.725 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.4 m -54.21 -43.22 70.61 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.18 -0.95 . . . . 0.0 108.439 178.336 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -63.19 -39.39 94.52 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 119.636 -0.826 . . . . 0.0 108.871 177.991 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -95.3 53.61 1.53 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.223 -0.923 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.55 37.83 3.79 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.094 -1.004 . . . . 0.0 110.33 179.859 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.79 126.62 2.31 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -28.54 46.48 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.129 -1.218 . . . . 0.0 110.102 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -57.14 -33.05 67.0 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.002 -1.061 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -49.36 -37.87 26.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.99 -1.069 . . . . 0.0 110.915 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -59.65 -56.38 22.58 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.096 -1.002 . . . . 0.0 109.479 179.465 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.25 -38.89 81.15 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.227 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.54 -36.69 69.53 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.106 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.865 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.3 t -55.65 -35.46 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.056 -1.028 . . . . 0.0 110.31 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.5 mtpt -52.93 -40.38 63.56 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.879 -1.138 . . . . 0.0 110.115 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.97 -29.95 63.67 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 179.11 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.61 -53.31 23.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.907 -1.121 . . . . 0.0 110.094 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 41.1 p90 -100.2 36.01 1.96 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.117 -0.99 . . . . 0.0 111.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.71 -36.76 23.46 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.705 -1.247 . . . . 0.0 110.359 179.144 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mttp -104.8 23.63 13.15 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.217 -0.927 . . . . 0.0 111.229 179.564 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.474 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.3 t90 -105.19 -49.87 3.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.886 -1.134 . . . . 0.0 110.414 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.474 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -104.94 -47.97 3.87 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.142 -0.974 . . . . 0.0 110.38 179.939 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 54.62 38.62 30.25 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.917 -1.114 . . . . 0.0 110.628 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -151.77 -65.94 0.18 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.21 -0.931 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.35 82.41 0.41 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.165 -0.959 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.64 73.04 1.5 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.372 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -121.12 33.67 5.47 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.157 -0.964 . . . . 0.0 110.609 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -50.44 3.04 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.027 -1.046 . . . . 0.0 109.825 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -21.08 63.5 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.179 -0.95 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.842 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.36 -38.73 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 O-C-N 120.673 -1.267 . . . . 0.0 109.944 179.742 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -83.55 -39.21 20.69 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.121 -0.987 . . . . 0.0 110.079 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -37.89 89.06 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.132 -0.98 . . . . 0.0 110.007 179.596 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.0 m . . . . . 0 N--CA 1.507 2.414 0 O-C-N 121.079 -1.013 . . . . 0.0 110.287 179.756 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.444 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 53.8 mttp . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.68 ' HD2' HD13 ' A' ' 13' ' ' LEU . 67.5 t80 -110.14 161.73 15.28 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.226 -0.921 . . . . 0.0 110.06 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -125.44 133.91 52.29 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.25 99.75 7.84 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.068 -1.02 . . . . 0.0 110.003 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -52.74 -36.02 56.99 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 120.977 -1.077 . . . . 0.0 110.548 179.942 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 94.9 m-85 -62.8 -30.43 71.46 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.097 -1.002 . . . . 0.0 110.267 179.243 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 50.0 m -99.84 -12.04 20.23 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.981 -1.074 . . . . 0.0 111.979 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.5 t70 57.14 41.88 26.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.405 -1.434 . . . . 0.0 109.972 -179.42 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -143.73 174.23 10.98 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 5.7 t80 -115.8 112.72 22.4 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.274 -0.892 . . . . 0.0 110.46 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.697 HD21 ' ND1' ' A' ' 24' ' ' HIS . 3.6 mp -65.91 171.27 4.57 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.233 -0.917 . . . . 0.0 109.713 179.688 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.433 HG23 ' CG ' ' A' ' 15' ' ' HIS . 13.5 t -97.34 -30.1 13.14 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.235 -0.916 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 31.9 m170 -115.45 148.87 38.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.952 -1.092 . . . . 0.0 110.34 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -126.45 93.97 3.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 109.692 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -147.24 178.87 1.3 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.201 -0.937 . . . . 0.0 110.082 -179.641 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.58 -31.18 13.89 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.326 1.172 . . . . 0.0 110.971 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 t -88.13 -38.78 15.08 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.958 -1.089 . . . . 0.0 110.029 179.443 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 64.3 t -61.89 -45.84 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 121.081 -1.012 . . . . 0.0 109.416 179.568 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 24.5 mtt180 -59.35 -52.24 66.48 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.464 179.768 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -41.02 97.9 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.858 178.918 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -56.19 -43.22 78.25 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.098 -1.001 . . . . 0.0 108.564 178.249 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.697 ' ND1' HD21 ' A' ' 13' ' ' LEU . 64.8 t60 -61.71 -34.56 76.01 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.27 178.086 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -100.47 40.35 1.27 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.071 -1.018 . . . . 0.0 110.633 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 28.8 m -116.27 38.5 3.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.171 -0.956 . . . . 0.0 110.003 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.65 129.93 4.53 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -54.57 -28.56 46.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.189 -1.183 . . . . 0.0 110.403 179.155 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -60.07 -36.85 78.27 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.964 -1.085 . . . . 0.0 110.475 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -51.38 -36.37 43.02 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 120.942 -1.099 . . . . 0.0 110.632 -179.704 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -55.57 -52.03 65.1 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.0 -1.063 . . . . 0.0 109.768 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -61.11 -40.53 94.09 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.405 -0.918 . . . . 0.0 108.996 178.778 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -56.56 -37.07 70.03 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.252 -0.905 . . . . 0.0 110.3 179.171 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 50' ' ' ILE . 97.6 t -64.94 -37.02 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.083 -1.011 . . . . 0.0 110.048 179.8 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.1 tppt? -53.71 -42.43 68.04 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 120.83 -1.169 . . . . 0.0 109.925 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.66 -28.04 65.34 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.424 179.067 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -72.86 -51.54 18.33 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.893 -1.129 . . . . 0.0 110.528 -179.752 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.2 p90 -99.63 35.4 2.0 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.03 -1.044 . . . . 0.0 111.415 179.97 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.68 -39.11 15.27 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.828 -1.17 . . . . 0.0 109.98 178.85 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -116.72 34.22 5.18 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.252 -0.905 . . . . 0.0 110.599 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.4 t90 -91.51 -39.03 12.16 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.175 -0.953 . . . . 0.0 110.282 -179.853 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 mtm -154.32 -67.24 0.14 Allowed 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.121 -0.987 . . . . 0.0 110.579 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -135.05 -171.82 2.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.192 -0.943 . . . . 0.0 110.126 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -110.12 39.42 2.16 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.0 110.154 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -146.7 74.33 1.35 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.162 -0.961 . . . . 0.0 110.266 179.876 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.41 73.35 1.37 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.95 35.06 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.113 -0.992 . . . . 0.0 110.502 179.58 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 59.9 p -109.71 -53.48 2.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.149 -0.969 . . . . 0.0 109.473 179.265 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -20.96 63.48 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.216 -0.928 . . . . 0.0 111.339 179.205 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 34' ' ' VAL . 49.0 mm -74.33 -47.21 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.66 -1.275 . . . . 0.0 109.701 179.628 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -58.27 -40.03 80.81 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.214 -0.928 . . . . 0.0 110.068 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.1 mttm -57.41 -35.91 70.65 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.577 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.4 m . . . . . 0 N--CA 1.504 2.232 0 O-C-N 120.965 -1.084 . . . . 0.0 110.394 179.921 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -115.23 159.47 20.93 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.191 -0.943 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -136.61 139.48 42.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.099 -1.001 . . . . 0.0 110.7 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.1 t -112.23 96.98 6.33 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.896 . . . . 0.0 110.105 179.519 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -54.8 -36.43 64.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.056 -1.028 . . . . 0.0 110.339 179.865 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.864 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.0 m-85 -60.44 -32.08 71.02 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.117 -0.989 . . . . 0.0 110.049 179.23 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.7 m -96.91 -2.74 43.16 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.957 -1.089 . . . . 0.0 112.14 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 53.77 38.69 29.08 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.397 -1.44 . . . . 0.0 110.475 -179.545 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -140.1 174.85 10.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -0.912 . . . . 0.0 109.899 179.894 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.79 121.77 38.9 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.268 -0.895 . . . . 0.0 110.258 -179.633 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -80.52 166.51 21.11 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.043 -1.036 . . . . 0.0 109.544 179.371 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 t -100.89 -29.5 12.19 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.125 -0.984 . . . . 0.0 111.891 -179.535 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.68 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.0 m170 -112.23 146.79 37.52 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.824 -1.173 . . . . 0.0 110.276 -179.821 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -125.13 93.51 3.9 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 109.849 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.21 178.68 1.36 Allowed Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.39 -31.27 14.26 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.267 1.14 . . . . 0.0 110.87 179.888 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -87.16 -40.15 14.86 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.937 -1.102 . . . . 0.0 109.979 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 15' ' ' HIS . 85.3 t -61.57 -49.03 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 121.183 -0.948 . . . . 0.0 109.476 179.655 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.6 mtp-105 -58.39 -50.76 72.51 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.53 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -62.08 -41.16 97.9 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.111 -0.993 . . . . 0.0 108.803 178.803 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.4 m -55.67 -43.38 76.3 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.13 -0.981 . . . . 0.0 108.451 178.376 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -62.33 -38.76 90.72 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.404 -0.81 . . . . 0.0 108.922 178.02 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -92.7 55.86 2.53 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.227 -0.921 . . . . 0.0 110.31 -179.988 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.98 37.4 4.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.055 -1.028 . . . . 0.0 110.326 179.789 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.28 128.64 3.46 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.0 ttp-105 -54.64 -28.12 44.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.171 -1.193 . . . . 0.0 110.639 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -62.47 -34.1 76.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.929 -1.107 . . . . 0.0 110.574 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.7 t-80 -51.58 -41.78 61.43 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.946 -1.096 . . . . 0.0 110.583 -179.595 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -62.54 -54.65 36.7 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.091 179.31 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -39.15 83.9 Favored 'General case' 0 N--CA 1.508 2.471 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.117 178.572 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -55.94 -38.18 69.97 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.227 -0.92 . . . . 0.0 110.069 179.172 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.864 HG13 ' CD1' ' A' ' 8' ' ' TYR . 95.2 t -65.95 -34.51 70.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.148 -0.97 . . . . 0.0 110.025 179.61 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 25.4 tttt -52.14 -39.92 60.64 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.909 -1.119 . . . . 0.0 109.983 179.431 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -59.07 -29.49 67.37 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 178.903 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -71.72 -53.09 14.6 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.862 -1.149 . . . . 0.0 110.278 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.687 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 37.0 p90 -99.27 32.0 2.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.068 -1.02 . . . . 0.0 111.448 179.852 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.47 -38.94 54.59 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.728 -1.232 . . . . 0.0 110.138 179.166 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.11 31.28 5.83 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.212 -0.93 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.8 t90 -108.51 -57.42 2.13 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.073 -1.017 . . . . 0.0 110.404 -179.758 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.461 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.5 OUTLIER -123.11 54.05 1.27 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.232 -0.918 . . . . 0.0 110.015 -179.989 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 -171.36 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.022 -1.049 . . . . 0.0 110.581 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -82.29 -172.86 4.23 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.163 -0.961 . . . . 0.0 110.0 179.987 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 54.76 73.89 0.38 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.015 -1.053 . . . . 0.0 110.493 -179.801 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.687 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -148.97 69.99 1.09 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.202 -0.936 . . . . 0.0 110.413 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -114.0 33.94 4.94 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.274 -0.891 . . . . 0.0 110.589 179.62 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -105.9 -51.6 2.96 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.053 -1.03 . . . . 0.0 109.309 179.198 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.4 -21.65 62.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.239 -0.913 . . . . 0.0 111.355 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.736 HD12 HG11 ' A' ' 34' ' ' VAL . 50.1 mm -79.27 -46.31 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.595 -1.316 . . . . 0.0 109.741 179.633 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.72 -37.62 82.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -75.74 -35.53 60.18 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.148 -0.97 . . . . 0.0 110.584 179.946 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.506 2.335 0 O-C-N 121.08 -1.012 . . . . 0.0 110.071 179.852 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.448 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 26.3 mttt . . . . . 0 N--CA 1.501 2.123 0 CA-C-O 120.858 0.361 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.626 ' HD1' HD13 ' A' ' 13' ' ' LEU . 55.6 t80 -54.65 156.73 3.35 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.089 -1.007 . . . . 0.0 110.937 -179.553 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -137.75 129.75 28.82 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.36 -0.838 . . . . 0.0 109.145 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.2 t -109.99 92.69 4.15 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.024 -1.047 . . . . 0.0 110.523 179.89 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.13 -35.35 59.59 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.059 -1.026 . . . . 0.0 110.201 179.327 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.828 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -60.44 -34.43 73.97 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.109 -0.995 . . . . 0.0 109.941 179.14 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.8 m -96.27 -0.29 49.9 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.089 -1.007 . . . . 0.0 112.136 -179.922 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.55 38.57 26.07 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.365 -1.459 . . . . 0.0 110.678 -179.755 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -139.56 166.97 23.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.979 . . . . 0.0 110.042 179.9 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.448 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 22.4 t80 -120.35 127.11 52.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.211 -0.931 . . . . 0.0 110.22 -179.712 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.626 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -84.86 167.58 15.87 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.527 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.459 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.3 t -99.47 -31.62 11.55 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.114 -0.991 . . . . 0.0 111.708 -179.34 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.459 ' CG ' HG23 ' A' ' 14' ' ' THR . 29.8 m170 -117.72 139.43 51.05 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.899 -1.126 . . . . 0.0 110.278 -179.872 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -114.66 94.18 4.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.215 -0.928 . . . . 0.0 109.821 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -139.21 178.72 1.52 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.292 -0.88 . . . . 0.0 110.072 -179.653 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.76 -32.2 14.81 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.351 1.185 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.72 -44.4 11.83 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.966 -1.084 . . . . 0.0 109.737 179.44 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.2 t -60.43 -51.35 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 121.17 -0.956 . . . . 0.0 109.552 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -58.49 -50.47 73.62 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.084 -1.01 . . . . 0.0 109.393 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -61.32 -40.12 93.05 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.874 178.77 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 68.9 m -54.07 -42.87 69.78 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.105 -0.997 . . . . 0.0 108.562 178.262 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -63.06 -39.85 95.93 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.361 -0.837 . . . . 0.0 108.898 178.135 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.81 56.64 2.35 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.32 -0.862 . . . . 0.0 110.089 -179.912 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.95 37.74 3.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.154 -0.966 . . . . 0.0 110.362 179.892 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -149.51 124.59 1.82 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.991 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -28.31 39.13 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.075 -1.25 . . . . 0.0 110.4 178.946 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -60.07 -31.34 69.92 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.948 -1.095 . . . . 0.0 110.691 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.508 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.1 t-80 -49.04 -38.1 22.87 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.91 -1.119 . . . . 0.0 110.986 -179.499 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.21 -54.66 29.96 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.014 179.284 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -60.91 -39.28 88.75 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.034 178.703 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -55.94 -37.04 68.44 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.191 -0.943 . . . . 0.0 110.075 179.15 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.828 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.1 t -55.22 -36.44 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.635 0 O-C-N 121.033 -1.042 . . . . 0.0 110.035 179.769 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.4 tttt -57.6 -42.24 82.84 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 120.969 -1.082 . . . . 0.0 109.481 179.309 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -59.18 -26.86 65.17 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.305 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -70.12 -52.52 23.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.893 -1.129 . . . . 0.0 110.406 -179.924 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.538 ' HE1' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -97.45 20.94 10.85 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.036 -1.04 . . . . 0.0 111.947 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -61.48 -40.0 92.97 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.6 -1.312 . . . . 0.0 109.848 179.192 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.22 31.38 6.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.23 -0.919 . . . . 0.0 110.875 179.723 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CE2' ' HE1' ' A' ' 42' ' ' MET . 24.2 t90 -77.29 -59.17 2.89 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.133 -0.979 . . . . 0.0 110.316 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.427 ' HE1' ' CE2' ' A' ' 41' ' ' TRP . 7.1 tpp -137.52 -59.55 0.67 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.121 -0.987 . . . . 0.0 110.539 -179.788 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -114.86 -173.54 2.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.162 -0.961 . . . . 0.0 110.411 -179.797 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -97.49 -35.78 10.54 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.27 -0.894 . . . . 0.0 110.849 -179.946 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -106.13 83.79 1.95 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.93 -1.106 . . . . 0.0 110.399 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.505 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -115.47 70.41 0.75 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.247 -0.908 . . . . 0.0 109.873 179.715 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.66 34.86 4.53 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.199 -0.938 . . . . 0.0 110.54 179.847 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 t -107.49 -53.78 2.57 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.087 -1.008 . . . . 0.0 109.213 179.118 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.17 -20.7 64.41 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.307 -0.87 . . . . 0.0 111.31 179.109 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.526 HD12 HG11 ' A' ' 34' ' ' VAL . 49.4 mm -77.58 -40.64 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 120.731 -1.231 . . . . 0.0 109.894 179.797 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -58.53 -38.65 78.22 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.175 -0.953 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -73.46 -37.35 65.83 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.157 -0.964 . . . . 0.0 110.202 179.772 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.506 2.363 0 O-C-N 121.045 -1.035 . . . . 0.0 110.366 179.742 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.41 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 5.8 mtmm . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 13' ' ' LEU . 64.6 t80 -111.28 157.86 19.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.158 -0.964 . . . . 0.0 110.141 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -125.95 135.72 52.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.164 -0.96 . . . . 0.0 110.62 -179.755 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.3 t -113.34 95.0 5.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.188 -0.945 . . . . 0.0 110.019 179.495 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -53.03 -36.08 60.15 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.062 -1.024 . . . . 0.0 110.478 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.836 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.0 m-85 -60.19 -32.96 71.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.088 -1.007 . . . . 0.0 109.927 179.108 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' HG22 ' A' ' 11' ' ' THR . 25.1 m -95.47 -0.08 52.7 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.011 -1.056 . . . . 0.0 112.061 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.95 38.57 24.06 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.435 -1.416 . . . . 0.0 110.635 -179.783 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.6 t -148.9 171.15 16.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.291 -0.881 . . . . 0.0 110.149 179.933 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -117.36 124.94 50.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.198 -0.939 . . . . 0.0 110.238 -179.664 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.479 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.3 mp -74.2 170.16 16.11 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.132 -0.98 . . . . 0.0 109.784 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.541 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.6 t -101.02 -21.36 15.05 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.236 -0.915 . . . . 0.0 112.176 -179.712 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.716 ' HB2' HG11 ' A' ' 20' ' ' VAL . 48.9 m-70 -119.4 147.28 44.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.53 -1.356 . . . . 0.0 110.291 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -124.47 94.84 4.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.22 -0.925 . . . . 0.0 109.961 179.813 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.67 177.4 1.79 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.187 -0.946 . . . . 0.0 110.413 -179.625 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.86 -32.71 13.58 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.41 1.216 . . . . 0.0 110.845 179.849 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 m -87.26 -38.95 15.84 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.043 -1.036 . . . . 0.0 110.027 179.552 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.716 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.0 t -60.38 -49.31 84.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 179.645 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.405 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 19.9 mtt180 -58.26 -50.81 72.29 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.079 -1.013 . . . . 0.0 109.605 179.648 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.57 -41.33 98.87 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.346 -0.941 . . . . 0.0 108.748 178.825 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.5 m -55.96 -43.29 77.36 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.221 -0.924 . . . . 0.0 108.625 178.416 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.479 ' ND1' HD21 ' A' ' 13' ' ' LEU . 76.4 t60 -61.79 -36.25 80.55 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.701 -0.8 . . . . 0.0 109.199 178.218 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.14 52.31 1.28 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.135 -0.978 . . . . 0.0 110.274 -179.813 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -116.49 37.98 3.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.244 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.12 127.1 2.77 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 -179.981 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.7 ttt-85 -54.93 -28.05 47.98 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.097 -1.237 . . . . 0.0 110.342 179.179 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -60.05 -34.45 73.42 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.957 -1.09 . . . . 0.0 110.507 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.651 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.2 t-80 -51.09 -39.1 55.31 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.948 -1.095 . . . . 0.0 110.537 -179.484 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -63.19 -55.37 25.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.101 -1.0 . . . . 0.0 109.084 179.328 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.95 -39.23 84.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.23 -0.919 . . . . 0.0 109.199 178.701 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -56.94 -38.18 72.56 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.217 -0.927 . . . . 0.0 110.036 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.836 HG13 ' CD2' ' A' ' 8' ' ' TYR . 90.0 t -58.19 -35.21 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.154 -0.966 . . . . 0.0 110.067 179.684 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.9 ttmt -52.27 -40.52 61.87 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.969 -1.082 . . . . 0.0 109.952 179.535 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -58.13 -29.95 65.95 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.577 -0.849 . . . . 0.0 110.298 178.96 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -69.2 -52.8 24.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.877 -1.14 . . . . 0.0 110.042 179.909 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.7 p90 -100.35 35.83 2.02 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.138 -0.976 . . . . 0.0 111.083 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -38.08 16.32 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.799 -1.188 . . . . 0.0 110.044 178.921 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -107.47 26.75 9.85 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.1 t90 -106.74 -55.99 2.25 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.966 -1.084 . . . . 0.0 109.893 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 1.3 mtm -128.64 55.43 1.7 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.252 -0.905 . . . . 0.0 109.713 179.711 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 55.8 -163.48 0.15 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.933 -1.104 . . . . 0.0 110.337 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -99.74 48.94 0.93 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.13 -0.981 . . . . 0.0 110.221 179.92 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -140.11 73.06 1.41 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.212 -0.93 . . . . 0.0 109.959 179.736 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.79 73.4 0.62 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.272 -0.892 . . . . 0.0 110.793 -179.823 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -112.51 35.3 3.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.16 -0.962 . . . . 0.0 110.434 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -109.06 -52.72 2.73 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.112 -0.992 . . . . 0.0 109.586 179.289 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.47 -20.93 63.7 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.232 -0.918 . . . . 0.0 111.464 179.335 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.756 HD12 HG11 ' A' ' 34' ' ' VAL . 48.7 mm -74.67 -45.95 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 120.747 -1.221 . . . . 0.0 109.835 179.842 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -65.4 -40.7 93.76 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.229 -0.919 . . . . 0.0 110.067 -179.938 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -58.32 -36.75 73.85 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.147 -0.971 . . . . 0.0 110.532 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.504 2.251 0 O-C-N 121.018 -1.052 . . . . 0.0 110.422 179.91 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -111.46 160.87 16.71 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.19 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -143.68 131.15 21.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.161 -0.962 . . . . 0.0 110.375 -179.48 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.0 t -109.93 87.1 2.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.154 -0.967 . . . . 0.0 109.684 179.13 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -50.37 -35.71 29.24 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.11 -0.994 . . . . 0.0 110.937 -179.562 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.843 ' CD2' HG13 ' A' ' 34' ' ' VAL . 25.5 m-85 -61.82 -30.64 70.96 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.084 -1.01 . . . . 0.0 109.919 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.1 m -98.48 0.52 45.3 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.943 -1.098 . . . . 0.0 112.058 179.674 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 52.89 38.08 25.96 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.395 -1.44 . . . . 0.0 110.839 -179.881 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -139.4 168.93 18.71 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.191 -0.943 . . . . 0.0 109.999 179.571 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -121.83 140.27 52.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.175 -0.953 . . . . 0.0 110.886 -179.69 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -106.44 152.63 23.38 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.247 -0.908 . . . . 0.0 109.39 179.302 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.485 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -99.1 -30.71 12.15 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.113 -0.992 . . . . 0.0 111.693 -179.519 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.485 ' CD2' HG23 ' A' ' 14' ' ' THR . 50.3 m-70 -111.46 125.3 53.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.823 -1.173 . . . . 0.0 110.189 179.989 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -110.2 88.53 2.78 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.114 -0.991 . . . . 0.0 109.742 179.679 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -133.24 -179.78 1.17 Allowed Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 109.81 -179.602 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -71.05 -26.97 20.97 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.271 1.142 . . . . 0.0 111.238 179.885 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.0 m -90.17 -40.22 12.35 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.742 -1.224 . . . . 0.0 110.053 179.482 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.6 t -69.04 -48.35 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.06 -1.025 . . . . 0.0 109.699 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -59.06 -51.42 70.1 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.079 -1.013 . . . . 0.0 109.467 179.77 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -59.32 -40.2 85.5 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.163 -0.961 . . . . 0.0 108.891 178.862 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 49.7 m -54.67 -43.02 72.06 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.07 -1.019 . . . . 0.0 108.303 178.301 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -66.09 -40.93 91.19 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.739 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.66 57.15 2.49 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.322 -0.861 . . . . 0.0 110.093 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -113.34 37.97 3.03 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.047 -1.033 . . . . 0.0 110.453 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.12 124.49 1.61 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -53.76 -28.72 36.31 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.157 -1.202 . . . . 0.0 110.27 179.068 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -59.33 -31.24 68.99 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 110.701 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.2 t-80 -48.85 -48.05 42.25 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.927 -1.108 . . . . 0.0 111.175 -179.382 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -58.86 -53.33 59.57 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.053 -1.029 . . . . 0.0 109.37 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.44 -38.98 85.86 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.163 -0.961 . . . . 0.0 109.036 178.556 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -56.46 -38.98 72.4 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.24 -0.912 . . . . 0.0 110.027 179.249 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.843 HG13 ' CD2' ' A' ' 8' ' ' TYR . 97.3 t -60.17 -38.03 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.092 -1.005 . . . . 0.0 109.76 179.747 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 27.3 ttmt -53.65 -39.73 65.28 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.961 -1.087 . . . . 0.0 109.97 179.441 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -58.63 -34.74 71.51 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.209 -0.932 . . . . 0.0 109.997 179.162 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -64.27 -52.47 58.49 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.036 -1.04 . . . . 0.0 109.931 179.867 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.4 p90 -100.6 35.43 2.15 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.118 -0.989 . . . . 0.0 110.991 179.491 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -84.61 -37.71 20.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.8 -1.187 . . . . 0.0 110.267 179.138 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -111.5 21.82 15.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.132 -0.98 . . . . 0.0 111.482 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.7 t90 -60.44 -46.91 88.35 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.861 -1.149 . . . . 0.0 109.963 179.949 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.5 mtm -151.68 36.74 0.57 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.155 -0.965 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 50.9 41.63 27.13 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.011 -1.055 . . . . 0.0 110.899 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.4 -168.03 2.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.162 -0.961 . . . . 0.0 110.318 -179.931 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -117.96 124.86 49.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -125.78 76.7 1.6 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.241 -0.912 . . . . 0.0 110.259 -179.898 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.81 35.71 3.26 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.201 -0.937 . . . . 0.0 110.57 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.3 t -112.77 -55.66 2.5 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.209 -0.932 . . . . 0.0 109.378 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -21.28 64.25 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.225 -0.922 . . . . 0.0 111.064 179.075 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.814 HD12 HG11 ' A' ' 34' ' ' VAL . 47.5 mm -69.92 -41.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.608 -1.307 . . . . 0.0 109.306 179.498 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -71.46 -37.04 71.4 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.19 -0.944 . . . . 0.0 110.327 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -80.3 -36.31 34.53 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.106 -0.996 . . . . 0.0 110.367 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.507 2.416 0 O-C-N 121.08 -1.013 . . . . 0.0 110.339 179.972 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 18.2 mtmt . . . . . 0 N--CA 1.495 1.799 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.9 t80 -107.74 161.36 14.96 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.132 -0.98 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -133.83 134.25 42.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.251 -0.906 . . . . 0.0 110.157 -179.714 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.8 t -114.59 96.51 5.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.154 -0.966 . . . . 0.0 110.158 179.603 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.56 -35.99 61.36 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.985 -1.072 . . . . 0.0 110.385 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.813 ' CD2' HG13 ' A' ' 34' ' ' VAL . 92.6 m-85 -61.24 -32.57 72.37 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.033 -1.042 . . . . 0.0 110.132 179.222 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.4 m -97.08 -4.58 39.25 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.954 -1.091 . . . . 0.0 112.163 -179.982 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.47 39.67 30.3 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.371 -1.456 . . . . 0.0 110.442 -179.698 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.98 171.61 13.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.307 -0.871 . . . . 0.0 110.051 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.437 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 12.9 t80 -118.45 133.21 56.06 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.254 -0.904 . . . . 0.0 110.328 -179.753 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -89.11 165.65 14.36 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.185 -0.947 . . . . 0.0 109.752 179.588 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 t -98.83 -29.92 12.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.134 -0.979 . . . . 0.0 111.698 -179.567 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.744 ' HB2' HG11 ' A' ' 20' ' ' VAL . 32.5 m170 -111.05 146.36 36.87 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.877 -1.139 . . . . 0.0 110.189 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.11 93.19 3.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.453 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.3 178.69 1.37 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.234 -0.916 . . . . 0.0 110.172 -179.594 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.15 -30.72 15.71 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.442 1.233 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.73 -40.38 12.55 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.996 -1.065 . . . . 0.0 109.988 179.647 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.744 HG11 ' HB2' ' A' ' 15' ' ' HIS . 90.3 t -60.06 -50.46 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.641 179.813 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HD3' ' CE2' ' A' ' 4' ' ' PHE . 19.7 mtt180 -58.86 -50.75 72.85 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.684 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -61.66 -40.29 94.41 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.17 -0.957 . . . . 0.0 108.832 178.817 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -54.53 -43.31 71.81 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.1 -1.0 . . . . 0.0 108.358 178.223 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -62.48 -37.78 87.33 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.008 177.814 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.07 48.35 1.0 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.133 -0.98 . . . . 0.0 110.442 -179.82 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.01 38.02 3.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.118 -0.989 . . . . 0.0 110.241 179.757 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.54 128.17 3.28 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.1 ttm105 -54.61 -28.5 47.05 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.144 -1.209 . . . . 0.0 110.361 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -59.15 -35.56 73.71 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.883 -1.135 . . . . 0.0 110.392 179.772 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.667 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.7 t-80 -51.4 -39.1 56.53 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.023 -1.048 . . . . 0.0 110.5 -179.611 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -62.67 -55.6 25.36 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.136 -0.977 . . . . 0.0 109.128 179.406 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -60.13 -39.25 85.62 Favored 'General case' 0 N--CA 1.509 2.517 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.159 178.807 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -57.36 -37.14 72.15 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.301 -0.875 . . . . 0.0 110.053 179.232 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.974 HG11 HD12 ' A' ' 50' ' ' ILE . 73.0 t -56.86 -37.09 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.022 -1.049 . . . . 0.0 110.156 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.8 ttpt -54.13 -40.79 67.71 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.913 -1.117 . . . . 0.0 109.718 179.445 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.95 -28.63 66.46 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.359 178.911 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.74 -53.11 16.79 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.888 -1.132 . . . . 0.0 110.134 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.7 p90 -99.91 32.66 2.83 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.208 -0.933 . . . . 0.0 111.294 179.625 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -74.17 -35.97 64.05 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.73 -1.231 . . . . 0.0 110.258 179.184 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -107.28 27.0 9.51 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.121 -0.987 . . . . 0.0 111.091 179.61 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.448 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 10.6 t90 -109.45 -55.81 2.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.055 -1.028 . . . . 0.0 110.047 179.922 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.48 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 3.7 mtm -141.58 57.73 1.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.224 -0.923 . . . . 0.0 109.889 179.67 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -51.18 -36.21 40.0 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.056 -1.027 . . . . 0.0 110.97 -179.711 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -53.36 -58.69 6.22 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.966 -1.084 . . . . 0.0 110.511 -179.852 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.82 87.46 1.92 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.161 -0.962 . . . . 0.0 110.155 179.892 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -130.49 71.5 1.46 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.156 -0.965 . . . . 0.0 110.546 -179.888 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -144.3 34.89 1.2 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.162 -0.961 . . . . 0.0 110.573 179.426 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -53.42 2.65 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.204 -0.935 . . . . 0.0 109.393 179.192 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.24 65.04 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 111.249 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.974 HD12 HG11 ' A' ' 34' ' ' VAL . 51.1 mm -76.85 -51.97 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 120.647 -1.283 . . . . 0.0 109.787 179.806 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.2 -39.66 91.04 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.239 -0.913 . . . . 0.0 110.116 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -57.12 -37.69 72.34 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.072 -1.018 . . . . 0.0 110.507 -179.794 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.9 m . . . . . 0 N--CA 1.503 2.185 0 O-C-N 121.067 -1.021 . . . . 0.0 110.347 179.96 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.7 mttt . . . . . 0 N--CA 1.501 2.109 0 CA-C-O 120.846 0.355 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -123.78 162.38 23.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.15 -0.969 . . . . 0.0 110.308 -179.441 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -138.15 134.19 34.26 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.205 -0.935 . . . . 0.0 110.47 -179.603 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.2 t -112.86 94.2 4.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.215 -0.928 . . . . 0.0 109.975 179.475 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -51.9 -36.05 47.48 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 121.068 -1.02 . . . . 0.0 110.569 179.95 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.84 ' CD2' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -61.2 -32.07 71.83 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.184 -0.947 . . . . 0.0 110.163 179.225 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.9 m -98.74 -4.38 33.62 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.073 -1.017 . . . . 0.0 112.358 -179.864 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.57 38.71 28.81 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.33 -1.481 . . . . 0.0 110.568 -179.642 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -139.61 170.9 15.05 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 109.637 179.785 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -117.77 135.6 53.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.16 -0.963 . . . . 0.0 110.695 -179.592 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -100.82 133.36 45.42 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.174 -0.954 . . . . 0.0 109.483 179.391 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.2 t -75.87 -24.08 55.67 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.187 -0.945 . . . . 0.0 111.881 -179.392 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.836 ' HB2' HG11 ' A' ' 20' ' ' VAL . 46.8 m-70 -110.93 137.8 48.11 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.761 -1.212 . . . . 0.0 110.428 -179.842 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -125.51 85.99 2.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.671 179.659 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.04 179.69 1.3 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.268 -0.895 . . . . 0.0 109.906 -179.496 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.446 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.01 -31.7 14.57 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.329 1.173 . . . . 0.0 110.896 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.5 m -86.13 -46.57 10.31 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.876 -1.14 . . . . 0.0 109.752 179.305 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.2 t -59.54 -52.72 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.164 -0.96 . . . . 0.0 109.687 179.739 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -56.39 -52.41 64.7 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.025 -1.047 . . . . 0.0 109.634 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -60.62 -39.9 89.89 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.941 178.82 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.1 m -55.31 -43.53 74.94 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.044 -1.035 . . . . 0.0 108.313 178.272 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -62.67 -38.87 92.03 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.845 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.15 50.03 1.07 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.318 -0.864 . . . . 0.0 110.399 -179.922 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.33 37.47 3.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -0.987 . . . . 0.0 110.336 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.18 127.16 2.78 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.94 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.27 -28.65 43.24 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.123 -1.222 . . . . 0.0 110.331 179.092 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -59.18 -33.36 70.85 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 120.949 -1.094 . . . . 0.0 110.57 179.735 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.603 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.58 -39.63 50.13 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.979 -1.076 . . . . 0.0 110.803 -179.545 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -54.77 33.15 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.118 -0.988 . . . . 0.0 109.127 179.368 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.84 -39.16 88.04 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.203 -0.936 . . . . 0.0 109.052 178.693 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -56.27 -37.29 69.6 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.209 -0.932 . . . . 0.0 110.103 179.057 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.84 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.0 t -55.1 -36.24 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.062 -1.024 . . . . 0.0 110.099 179.609 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 30.9 tttt -54.75 -40.9 69.79 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.928 -1.107 . . . . 0.0 109.714 179.328 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.77 -28.02 65.54 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.372 178.975 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -72.29 -52.79 14.69 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.869 -1.145 . . . . 0.0 110.314 -179.966 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 36.8 p90 -99.28 31.12 3.2 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.11 -0.994 . . . . 0.0 111.5 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.416 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER -72.85 -39.53 66.46 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.708 -1.245 . . . . 0.0 110.014 179.251 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -118.81 26.07 9.8 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.265 -0.897 . . . . 0.0 111.235 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 22.8 t90 -69.54 -42.49 74.57 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.962 -1.086 . . . . 0.0 110.078 -179.88 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.498 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.0 ttm -151.09 40.63 0.72 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.166 -0.959 . . . . 0.0 110.532 -179.974 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 52.57 -172.05 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.946 -1.096 . . . . 0.0 110.734 179.869 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 53.56 -172.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.102 -0.999 . . . . 0.0 110.67 -179.957 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -114.24 130.69 56.63 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.231 -0.918 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -120.19 75.29 1.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.291 -0.88 . . . . 0.0 110.114 -179.981 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.54 37.11 2.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.118 -0.989 . . . . 0.0 110.4 179.703 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.1 m -113.91 -55.34 2.51 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.153 -0.967 . . . . 0.0 109.687 179.485 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.03 -21.41 63.58 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.208 -0.933 . . . . 0.0 111.5 179.469 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.469 HD12 HG11 ' A' ' 34' ' ' VAL . 44.8 mm -67.21 -41.73 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.568 -1.332 . . . . 0.0 109.424 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.91 -39.81 95.03 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 179.887 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -66.78 -36.43 82.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.148 -0.97 . . . . 0.0 110.33 179.856 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.7 m . . . . . 0 N--CA 1.504 2.27 0 O-C-N 121.071 -1.018 . . . . 0.0 110.088 179.747 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.1 mtmt . . . . . 0 N--CA 1.493 1.684 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.642 ' HD1' HD13 ' A' ' 13' ' ' LEU . 89.4 t80 -114.91 162.04 17.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.126 -0.984 . . . . 0.0 110.405 -179.51 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -137.25 133.05 34.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.243 -0.911 . . . . 0.0 110.01 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 t -112.2 93.21 4.34 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.118 179.475 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -52.29 -36.03 51.87 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 121.026 -1.046 . . . . 0.0 110.367 179.813 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.859 ' CD2' HG13 ' A' ' 34' ' ' VAL . 85.4 m-85 -60.28 -30.88 69.74 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.205 -0.935 . . . . 0.0 110.196 178.982 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.1 m -100.81 -2.08 33.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.012 -1.055 . . . . 0.0 112.275 -179.713 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.88 38.34 26.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.407 -1.433 . . . . 0.0 110.664 -179.653 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -140.2 168.45 19.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.213 -0.929 . . . . 0.0 109.762 179.737 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -118.34 142.59 47.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.2 -0.938 . . . . 0.0 110.619 -179.524 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.642 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.5 mp -101.37 160.64 14.25 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.211 -0.931 . . . . 0.0 109.769 179.465 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.416 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.3 t -102.51 -30.35 11.03 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.191 -0.943 . . . . 0.0 112.045 -179.286 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.617 ' O ' HG11 ' A' ' 20' ' ' VAL . 32.8 m170 -113.57 111.76 22.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.79 -1.194 . . . . 0.0 110.533 -179.597 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -92.95 67.17 4.3 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.162 -0.961 . . . . 0.0 110.468 179.837 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -107.39 178.14 1.15 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.155 -0.966 . . . . 0.0 110.009 179.684 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.39 -30.7 15.07 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.332 1.175 . . . . 0.0 111.276 -179.816 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 m -86.89 -41.13 14.24 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.86 -1.15 . . . . 0.0 110.122 179.865 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.617 HG11 ' O ' ' A' ' 15' ' ' HIS . 88.7 t -58.45 -57.04 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 O-C-N 121.073 -1.017 . . . . 0.0 109.914 179.893 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -53.69 -50.21 66.35 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.947 -1.095 . . . . 0.0 110.094 -179.824 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -62.97 -41.07 99.44 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.741 178.781 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.05 -43.35 73.72 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.234 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -63.12 -38.49 91.37 Favored 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.832 177.908 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 t -97.6 49.55 1.04 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.366 -179.894 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -117.38 37.79 3.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.06 -1.025 . . . . 0.0 110.375 179.853 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.11 127.27 2.82 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.792 -1.323 . . . . 0.0 109.792 -179.906 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -54.35 -28.59 43.92 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.151 -1.205 . . . . 0.0 110.323 179.064 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -59.36 -33.63 71.4 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.982 -1.073 . . . . 0.0 110.53 179.764 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.5 t-80 -50.5 -38.71 45.71 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.98 -1.075 . . . . 0.0 110.793 -179.477 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -62.88 -55.63 24.39 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.165 -0.96 . . . . 0.0 109.153 179.31 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -59.4 -38.56 80.89 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.232 -0.917 . . . . 0.0 109.215 178.661 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.27 -38.26 70.95 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.204 -0.935 . . . . 0.0 110.116 179.327 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.859 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.9 t -58.03 -35.25 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.578 0 O-C-N 121.027 -1.045 . . . . 0.0 110.152 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 22.1 tttt -52.59 -40.58 62.78 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 121.006 -1.059 . . . . 0.0 110.075 179.613 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -57.94 -28.2 64.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.279 -0.888 . . . . 0.0 110.532 178.971 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -71.88 -52.37 17.67 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.856 -1.153 . . . . 0.0 110.386 -179.882 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 39.8 p90 -99.49 34.1 2.3 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.033 -1.042 . . . . 0.0 111.479 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -80.35 -39.88 27.73 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.758 -1.214 . . . . 0.0 110.074 179.035 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -117.75 34.64 5.05 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.202 -0.936 . . . . 0.0 110.533 179.711 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -92.21 -48.28 6.78 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.122 -0.986 . . . . 0.0 110.539 -179.751 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 tpp -146.02 -60.83 0.32 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.146 -0.971 . . . . 0.0 110.823 -179.785 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -121.8 -175.84 3.19 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.074 -1.016 . . . . 0.0 110.607 -179.603 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -99.89 -37.14 9.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.197 -0.939 . . . . 0.0 110.976 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -104.79 78.83 1.47 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.917 -1.115 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -116.46 74.76 0.92 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.213 -0.929 . . . . 0.0 110.011 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.9 35.06 3.37 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.206 -0.933 . . . . 0.0 110.673 179.843 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 m -109.8 -54.5 2.55 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.173 -0.954 . . . . 0.0 109.254 179.084 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.72 -20.92 64.02 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.266 -0.896 . . . . 0.0 111.313 179.184 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.539 HD12 HG11 ' A' ' 34' ' ' VAL . 47.2 mm -72.72 -40.71 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 120.701 -1.249 . . . . 0.0 109.663 179.703 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 -40.76 62.57 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.196 -0.94 . . . . 0.0 109.911 179.919 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -58.33 -34.41 70.58 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.211 -0.93 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.6 m . . . . . 0 N--CA 1.505 2.293 0 O-C-N 121.014 -1.054 . . . . 0.0 110.263 -179.942 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.7 mttt . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.609 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.8 t80 -112.08 161.51 16.42 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.207 -179.931 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -136.72 132.38 34.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.237 -0.914 . . . . 0.0 110.183 -179.573 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.0 t -111.97 94.46 4.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.095 -1.003 . . . . 0.0 110.083 179.526 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.08 -35.82 48.84 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.133 -0.979 . . . . 0.0 110.538 179.901 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.883 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.1 m-85 -61.6 -33.36 73.77 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.104 -0.997 . . . . 0.0 110.001 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.3 m -96.12 -3.43 44.58 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.102 -0.999 . . . . 0.0 112.176 179.968 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 52.68 39.33 28.26 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.379 -1.451 . . . . 0.0 110.538 -179.72 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.44 172.72 12.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.942 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -118.89 139.08 52.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.281 -0.887 . . . . 0.0 110.611 -179.62 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.609 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -99.08 168.24 10.2 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.209 -0.932 . . . . 0.0 109.626 179.462 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.79 -30.47 12.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.122 -0.986 . . . . 0.0 111.6 -179.601 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 45.2 m-70 -114.85 147.73 39.5 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.892 -1.13 . . . . 0.0 110.214 -179.89 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -126.55 90.6 3.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.197 -0.939 . . . . 0.0 109.801 179.94 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.447 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.32 178.32 1.48 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.227 -0.92 . . . . 0.0 110.177 -179.708 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 41.7 Cg_endo -70.12 -31.35 19.08 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.448 1.236 . . . . 0.0 110.802 179.856 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.41 -36.97 23.84 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.056 -1.027 . . . . 0.0 110.057 179.283 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 79.4 t -72.97 -48.81 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 121.029 -1.044 . . . . 0.0 109.821 179.677 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 21.6 mtm180 -57.27 -52.26 66.06 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.072 -1.018 . . . . 0.0 109.764 179.951 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -59.17 -39.52 82.76 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.13 -0.982 . . . . 0.0 109.203 179.056 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.3 m -55.98 -43.44 77.58 Favored 'General case' 0 N--CA 1.511 2.62 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.237 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -63.04 -40.27 97.21 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.889 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.6 55.83 2.27 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.395 -0.815 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.2 37.34 4.03 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.122 -0.986 . . . . 0.0 110.371 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.6 127.3 2.69 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.932 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -28.11 47.31 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.116 -1.226 . . . . 0.0 110.344 179.138 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -60.3 -33.18 71.99 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.939 -1.101 . . . . 0.0 110.626 179.775 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.95 -37.91 34.16 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.955 -1.091 . . . . 0.0 110.781 -179.662 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -62.61 -56.41 18.1 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.086 -1.008 . . . . 0.0 109.166 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.04 -38.59 79.68 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.223 -0.923 . . . . 0.0 109.156 178.764 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -56.59 -37.86 71.21 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 110.035 179.28 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.883 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.5 t -57.99 -36.34 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.127 -0.983 . . . . 0.0 109.982 179.756 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.7 ttpm? -54.89 -42.29 71.95 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.921 -1.112 . . . . 0.0 109.611 179.488 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.08 -28.33 64.48 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.298 -0.876 . . . . 0.0 110.373 178.899 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -70.23 -52.28 24.35 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.915 -1.116 . . . . 0.0 110.292 -179.841 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.4 p90 -99.77 34.39 2.28 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.096 -1.003 . . . . 0.0 111.358 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.71 -37.28 24.95 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.714 -1.241 . . . . 0.0 110.154 178.83 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -110.32 29.43 7.69 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 179.587 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.1 t90 -90.77 -40.23 11.93 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.014 -1.054 . . . . 0.0 109.973 179.878 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -154.89 -66.46 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.199 -0.938 . . . . 0.0 110.483 179.84 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -124.26 -164.34 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.196 -0.94 . . . . 0.0 110.09 179.971 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -126.9 38.71 4.05 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.104 -0.997 . . . . 0.0 110.378 179.725 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -159.13 75.05 0.67 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.224 -0.922 . . . . 0.0 110.504 179.886 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.17 82.96 1.96 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.137 -0.977 . . . . 0.0 110.349 -179.837 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -109.34 36.08 3.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.119 -0.988 . . . . 0.0 110.33 179.617 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.5 m -115.05 -55.55 2.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.088 -1.007 . . . . 0.0 109.608 179.416 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -22.31 61.97 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.222 -0.924 . . . . 0.0 111.153 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.661 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -66.39 -39.85 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 120.646 -1.284 . . . . 0.0 109.291 179.191 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -72.35 -36.16 68.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.226 -0.921 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -76.48 -35.6 58.31 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.036 -1.04 . . . . 0.0 110.615 179.93 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m . . . . . 0 N--CA 1.508 2.434 0 O-C-N 121.053 -1.029 . . . . 0.0 110.136 179.944 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HB2' ' OH ' ' A' ' 12' ' ' TYR . 32.4 mttm . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 . . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.579 ' HD2' HD13 ' A' ' 13' ' ' LEU . 73.9 t80 -113.1 161.86 16.61 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.082 -1.011 . . . . 0.0 110.292 -179.626 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -131.59 137.46 48.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.237 -0.914 . . . . 0.0 110.232 -179.82 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.08 97.9 6.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.145 -0.972 . . . . 0.0 109.989 179.512 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -51.93 -35.95 47.48 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.061 -1.025 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.841 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.8 m-85 -63.19 -32.26 73.61 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.091 -1.006 . . . . 0.0 110.167 179.38 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.8 m -98.2 -8.94 26.47 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.058 -1.026 . . . . 0.0 112.024 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 54.87 41.0 32.25 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.344 -1.472 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.09 173.28 11.66 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.246 -0.909 . . . . 0.0 110.025 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' OH ' ' HB2' ' A' ' 3' ' ' LYS . 5.1 t80 -120.08 131.52 55.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.577 -179.6 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.579 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.1 mp -88.84 170.45 10.72 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.143 -0.973 . . . . 0.0 109.7 179.48 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.41 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.2 t -96.93 -31.29 12.63 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.302 -0.873 . . . . 0.0 111.375 -179.83 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.724 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.3 m170 -112.24 146.75 37.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.824 -1.173 . . . . 0.0 110.125 179.916 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -126.27 93.96 3.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 109.861 179.919 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.456 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -148.63 178.47 1.45 Allowed Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.182 -0.949 . . . . 0.0 110.312 -179.533 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.46 -32.87 14.9 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.384 1.202 . . . . 0.0 110.852 179.873 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.8 m -83.99 -39.87 19.16 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.965 -1.085 . . . . 0.0 109.839 179.396 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.724 HG11 ' HB2' ' A' ' 15' ' ' HIS . 58.4 t -65.74 -47.39 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 O-C-N 121.081 -1.012 . . . . 0.0 109.642 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -57.19 -50.83 71.61 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.127 -0.983 . . . . 0.0 109.565 179.777 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -61.48 -40.96 96.46 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.22 -0.925 . . . . 0.0 108.732 178.803 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -54.19 -43.22 70.54 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.178 -0.951 . . . . 0.0 108.524 178.33 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -62.33 -37.71 86.67 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.348 -0.845 . . . . 0.0 108.853 178.076 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -96.58 51.66 1.18 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.202 -0.936 . . . . 0.0 110.317 -179.861 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m -117.1 37.64 3.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.28 128.34 3.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.919 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -28.61 45.54 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.136 -1.214 . . . . 0.0 110.351 179.172 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -59.37 -34.9 72.97 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.029 -1.044 . . . . 0.0 110.393 179.764 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.578 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.22 -39.01 55.63 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.961 -1.087 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -61.9 -55.09 33.29 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.114 179.27 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -38.84 83.6 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.217 -0.927 . . . . 0.0 109.193 178.65 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.35 -36.96 71.85 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.091 -1.005 . . . . 0.0 110.203 179.156 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.958 HG11 HD12 ' A' ' 50' ' ' ILE . 72.2 t -57.85 -35.39 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.08 -1.012 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.8 mmmt -52.65 -39.44 61.81 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.877 -1.14 . . . . 0.0 109.957 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.44 -28.82 65.64 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 178.9 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -73.28 -54.11 9.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.853 -1.154 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 31.6 p90 -98.56 31.73 2.78 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.088 -1.008 . . . . 0.0 111.508 179.88 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.88 -38.41 64.4 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.739 -1.226 . . . . 0.0 109.777 178.948 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.4 22.58 13.95 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.253 -0.904 . . . . 0.0 111.114 179.176 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.525 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.3 t90 -101.5 -49.31 4.07 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.908 -1.12 . . . . 0.0 109.804 179.662 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.525 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 28.2 mmt -111.98 -53.02 2.75 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.245 -0.91 . . . . 0.0 110.245 179.701 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 54.79 39.31 31.33 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.986 -1.071 . . . . 0.0 110.674 179.99 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -149.04 -66.29 0.23 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.179 -0.95 . . . . 0.0 110.439 179.888 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -166.89 77.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.193 -0.942 . . . . 0.0 110.851 -179.982 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.42 73.4 1.53 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.233 -0.917 . . . . 0.0 110.301 -179.799 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.09 33.62 5.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.162 -0.962 . . . . 0.0 110.524 179.445 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.1 p -107.27 -50.82 3.01 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.096 -1.002 . . . . 0.0 109.678 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.36 -21.84 60.45 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.219 -0.926 . . . . 0.0 111.527 179.369 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.958 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -76.66 -39.72 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 120.716 -1.24 . . . . 0.0 109.925 179.777 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -80.39 -40.72 25.97 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.153 -0.967 . . . . 0.0 109.958 179.758 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -58.06 -33.24 68.82 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -0.91 . . . . 0.0 110.685 179.816 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.4 m . . . . . 0 N--CA 1.505 2.309 0 O-C-N 120.997 -1.064 . . . . 0.0 110.109 179.945 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 34.7 mttt . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 120.637 0.256 . . . . 0.0 110.561 . . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.564 ' HD2' HD13 ' A' ' 13' ' ' LEU . 57.3 t80 -112.69 155.28 24.77 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.213 -0.93 . . . . 0.0 109.816 179.552 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -134.28 139.55 45.8 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.158 -0.964 . . . . 0.0 110.532 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.0 t -111.34 98.39 7.45 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.258 -0.901 . . . . 0.0 110.185 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -53.52 -35.79 61.05 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.148 -0.97 . . . . 0.0 110.462 179.72 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.85 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.1 m-85 -63.01 -33.12 74.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.105 -0.997 . . . . 0.0 110.306 179.44 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.4 m -98.75 -2.83 37.13 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.005 -1.059 . . . . 0.0 112.082 179.855 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 53.8 37.98 27.57 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.37 -1.456 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -131.32 171.66 13.08 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.168 -0.957 . . . . 0.0 109.98 179.697 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.412 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -125.06 107.64 11.01 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.905 . . . . 0.0 110.12 179.852 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.564 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.6 mp -67.31 166.74 13.74 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.167 -0.958 . . . . 0.0 109.854 -179.999 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.435 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.4 t -100.19 -30.42 11.93 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.266 -0.896 . . . . 0.0 111.628 -179.694 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.435 ' CG ' HG23 ' A' ' 14' ' ' THR . 31.3 m170 -115.85 139.76 49.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.819 -1.175 . . . . 0.0 110.184 -179.897 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -116.02 92.04 3.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.255 -0.903 . . . . 0.0 109.901 179.746 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.44 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -137.83 177.92 1.92 Allowed Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 -179.637 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.44 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.7 Cg_endo -70.32 -31.41 18.09 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.364 1.191 . . . . 0.0 110.974 179.995 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -43.78 11.72 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.972 -1.08 . . . . 0.0 109.842 179.501 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 15' ' ' HIS . 92.8 t -60.12 -49.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.636 179.842 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtp-105 -59.61 -50.85 72.26 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.038 -1.039 . . . . 0.0 109.332 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.07 -39.96 91.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.214 -0.929 . . . . 0.0 108.85 178.821 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.9 m -54.37 -42.84 70.79 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.057 -1.027 . . . . 0.0 108.611 178.32 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -62.73 -37.47 86.69 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 119.63 -0.828 . . . . 0.0 109.109 178.066 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.8 49.54 1.09 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.156 -0.965 . . . . 0.0 110.529 -179.727 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.89 40.31 2.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.096 -1.002 . . . . 0.0 109.782 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.37 148.96 19.95 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.666 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -79.64 -9.11 59.58 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.298 -1.119 . . . . 0.0 111.064 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -91.47 -21.34 20.97 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.678 -1.264 . . . . 0.0 111.449 179.657 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.9 t-80 -48.49 -37.52 17.67 Favored 'General case' 0 N--CA 1.518 2.953 0 O-C-N 120.743 -1.223 . . . . 0.0 110.968 -179.559 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -63.11 -54.26 40.71 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.092 -1.005 . . . . 0.0 108.981 179.241 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.26 -39.2 85.99 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.0 178.609 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.88 -37.37 68.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.167 -0.958 . . . . 0.0 110.103 179.218 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.85 HG13 ' CD2' ' A' ' 8' ' ' TYR . 69.4 t -56.13 -35.34 41.59 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 O-C-N 120.993 -1.067 . . . . 0.0 110.066 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.5 tptm -52.4 -39.93 61.5 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.905 -1.122 . . . . 0.0 110.056 179.562 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.67 -29.6 64.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -69.96 -53.04 19.56 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.901 -1.124 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.455 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -100.0 34.76 2.21 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.124 -0.985 . . . . 0.0 111.227 179.793 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.08 -35.86 23.44 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.744 -1.222 . . . . 0.0 110.3 178.978 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -105.17 23.23 13.99 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.043 -1.035 . . . . 0.0 111.289 179.553 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.519 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 14.9 t90 -99.76 -45.28 5.8 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.855 -1.153 . . . . 0.0 110.152 179.89 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.519 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -124.34 42.18 3.32 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.125 -0.984 . . . . 0.0 110.094 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.12 -75.46 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.294 -0.878 . . . . 0.0 110.919 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -168.97 44.36 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.775 -1.203 . . . . 0.0 111.124 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -147.47 75.38 1.36 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 179.954 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -155.93 74.57 0.86 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.25 -0.906 . . . . 0.0 110.74 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -118.43 36.62 4.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.178 -0.951 . . . . 0.0 110.518 179.676 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -113.22 -54.94 2.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.183 -0.948 . . . . 0.0 109.721 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.55 63.54 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.288 -0.883 . . . . 0.0 111.328 179.405 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.784 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -68.88 -40.93 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 120.693 -1.255 . . . . 0.0 109.464 179.597 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.75 -41.35 17.72 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.17 -0.956 . . . . 0.0 109.76 179.663 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -60.86 -32.41 71.83 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.288 -0.883 . . . . 0.0 110.457 179.676 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 83.3 m . . . . . 0 N--CA 1.504 2.253 0 O-C-N 120.977 -1.077 . . . . 0.0 110.323 -179.975 . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 12' ' ' TYR . 91.4 mttt . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 13' ' ' LEU . 44.7 t80 -104.57 148.85 26.05 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.3 -0.875 . . . . 0.0 109.465 179.47 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -125.08 130.15 51.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.2 -0.938 . . . . 0.0 110.542 -179.407 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.0 t -109.98 93.87 4.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.182 -0.949 . . . . 0.0 109.686 179.375 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -51.74 -36.41 47.04 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 121.158 -0.964 . . . . 0.0 111.035 -179.427 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.882 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.053 -1.029 . . . . 0.0 110.114 179.461 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -96.42 -4.23 42.12 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.002 -1.061 . . . . 0.0 111.952 179.605 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 53.68 47.25 24.21 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.428 -1.42 . . . . 0.0 110.66 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 t -140.95 171.26 14.32 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.265 -0.897 . . . . 0.0 110.373 179.852 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE2' ' CD ' ' A' ' 3' ' ' LYS . 12.1 t80 -126.66 104.68 8.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.991 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.678 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.4 mp -65.22 163.48 15.16 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.868 -179.739 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.427 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.4 t -99.3 -31.05 11.89 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.199 -0.938 . . . . 0.0 111.591 -179.611 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.427 ' CG ' HG23 ' A' ' 14' ' ' THR . 31.1 m170 -114.23 136.42 52.98 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.823 -1.173 . . . . 0.0 110.076 180.0 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -114.31 92.09 3.84 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.155 -0.966 . . . . 0.0 109.849 179.66 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.433 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.12 179.04 1.47 Allowed Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.232 -0.918 . . . . 0.0 109.983 -179.601 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.16 -30.84 15.52 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.293 1.154 . . . . 0.0 111.028 179.994 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.1 m -89.27 -43.73 10.76 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.942 -1.099 . . . . 0.0 109.887 179.607 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.9 t -59.26 -52.48 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.58 0 O-C-N 121.121 -0.987 . . . . 0.0 109.833 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 mtp-105 -58.2 -50.08 74.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.135 -0.978 . . . . 0.0 109.511 179.817 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt -61.47 -40.06 93.16 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.291 -0.963 . . . . 0.0 108.88 178.72 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 m -54.29 -43.03 70.71 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.109 -0.994 . . . . 0.0 108.539 178.269 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -62.7 -37.91 88.34 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.96 177.961 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.92 52.09 1.15 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.178 -0.952 . . . . 0.0 110.188 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.37 38.05 3.36 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.051 -1.031 . . . . 0.0 110.392 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.78 126.47 2.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.976 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -53.95 -28.72 38.98 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.107 -1.231 . . . . 0.0 110.378 179.217 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -60.4 -31.54 70.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 0.0 110.645 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.535 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.3 t-80 -49.52 -37.97 28.86 Favored 'General case' 0 N--CA 1.516 2.832 0 O-C-N 120.933 -1.105 . . . . 0.0 110.964 -179.564 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -62.23 -54.23 43.78 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.072 -1.018 . . . . 0.0 109.118 179.3 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.38 -38.43 83.89 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.123 178.612 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -56.57 -37.65 70.87 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.274 -0.891 . . . . 0.0 110.18 179.321 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.908 HG11 HD12 ' A' ' 50' ' ' ILE . 95.1 t -59.62 -39.32 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.123 -0.986 . . . . 0.0 109.722 179.645 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 52.3 mttt -54.06 -40.91 67.59 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.016 -1.052 . . . . 0.0 109.606 179.331 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.42 -34.92 69.44 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.052 178.993 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -62.15 -52.56 63.36 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.002 -1.061 . . . . 0.0 109.602 179.649 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 49.8 p90 -100.94 38.0 1.63 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.276 -0.89 . . . . 0.0 110.781 179.412 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -87.0 -37.35 17.6 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.927 -1.108 . . . . 0.0 110.067 178.874 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.35 19.25 14.7 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.179 -0.951 . . . . 0.0 111.179 179.244 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.6 t90 -105.86 -55.98 2.25 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.809 -1.182 . . . . 0.0 109.971 179.704 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 5.1 tpp -143.14 57.98 1.4 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.864 . . . . 0.0 109.855 179.963 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.22 89.23 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.525 0 O-C-N 121.206 -0.934 . . . . 0.0 110.254 -179.69 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.08 -58.73 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.249 -0.907 . . . . 0.0 110.733 179.891 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -159.71 76.32 0.65 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.302 -0.873 . . . . 0.0 110.722 179.868 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.15 71.0 1.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.182 -0.949 . . . . 0.0 110.386 -179.816 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.67 32.81 5.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.174 -0.954 . . . . 0.0 110.657 179.406 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -104.07 -48.67 3.82 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.08 -1.012 . . . . 0.0 109.568 179.297 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -21.25 62.78 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.169 -0.957 . . . . 0.0 111.469 179.491 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.908 HD12 HG11 ' A' ' 34' ' ' VAL . 50.3 mm -82.12 -53.11 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 120.646 -1.284 . . . . 0.0 109.945 179.728 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -56.88 -39.57 74.6 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.135 -0.978 . . . . 0.0 110.32 -179.855 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -57.14 -36.57 70.87 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.148 -0.97 . . . . 0.0 110.54 -179.922 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m . . . . . 0 N--CA 1.505 2.3 0 O-C-N 121.074 -1.016 . . . . 0.0 110.483 179.948 . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 20.3 mtmt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 21' ' ' ARG . 40.7 t80 -113.53 154.42 27.13 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.286 -0.884 . . . . 0.0 109.609 179.564 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -126.45 133.82 51.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.053 -1.029 . . . . 0.0 110.538 -179.851 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 45.9 t -109.8 97.7 7.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.502 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -54.32 -36.57 63.89 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.094 -1.004 . . . . 0.0 110.272 179.715 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.0 m-85 -59.84 -32.37 70.61 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.185 179.082 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.426 ' CB ' HG22 ' A' ' 11' ' ' THR . 33.8 m -97.02 -1.81 44.7 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.984 -1.073 . . . . 0.0 112.098 -179.894 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.63 39.17 27.79 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.352 -1.468 . . . . 0.0 110.399 -179.589 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 9' ' ' CYS . 9.3 t -145.83 175.31 10.51 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -122.03 122.67 39.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.363 -0.835 . . . . 0.0 110.285 -179.624 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.627 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.2 mp -76.44 170.41 16.42 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.101 -0.999 . . . . 0.0 109.506 179.283 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.9 t -100.15 -29.4 12.51 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.173 -0.954 . . . . 0.0 111.799 -179.661 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.721 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.3 m170 -110.94 146.53 36.43 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.758 -1.214 . . . . 0.0 110.388 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -125.38 93.68 3.93 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.772 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.75 176.7 2.08 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.25 -0.906 . . . . 0.0 110.27 -179.611 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -69.59 -32.08 19.99 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.401 1.211 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -86.05 -39.5 16.74 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.954 -1.091 . . . . 0.0 109.973 179.5 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 15' ' ' HIS . 75.7 t -63.38 -47.39 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.208 -0.932 . . . . 0.0 109.595 179.751 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 mtt180 -58.29 -51.64 68.94 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.082 -1.011 . . . . 0.0 109.632 179.941 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -62.29 -41.13 98.24 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.789 179.012 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.8 m -55.68 -43.17 76.11 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.074 -1.016 . . . . 0.0 108.522 178.324 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.627 ' ND1' HD21 ' A' ' 13' ' ' LEU . 72.3 t60 -61.83 -35.35 77.98 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.644 -0.823 . . . . 0.0 109.288 178.02 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -98.92 44.42 1.03 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.051 -1.03 . . . . 0.0 110.651 -179.795 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m -116.76 39.75 3.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.117 -0.989 . . . . 0.0 109.749 179.626 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.38 163.54 21.88 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -179.667 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -89.18 -11.72 42.97 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.281 -1.129 . . . . 0.0 110.842 178.689 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.69 -26.18 19.69 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.729 -1.232 . . . . 0.0 111.087 179.659 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.717 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.1 t-80 -50.67 -39.58 51.37 Favored 'General case' 0 N--CA 1.516 2.858 0 O-C-N 120.737 -1.227 . . . . 0.0 110.546 -179.577 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -64.13 -54.37 34.83 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.945 179.17 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -60.81 -39.53 89.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.116 178.588 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.2 -38.04 73.09 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.261 -0.899 . . . . 0.0 109.988 179.194 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.728 HG11 HD12 ' A' ' 50' ' ' ILE . 78.9 t -56.81 -37.76 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 121.036 -1.04 . . . . 0.0 109.964 179.703 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.5 ttpp -54.87 -41.24 70.6 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.966 -1.084 . . . . 0.0 109.716 179.435 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.64 -32.0 68.66 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.868 . . . . 0.0 110.15 178.963 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -67.66 -52.29 39.74 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.093 -1.004 . . . . 0.0 110.158 179.899 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.64 ' HE1' HG12 ' A' ' 34' ' ' VAL . 44.2 p90 -100.22 33.12 2.75 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.12 -0.987 . . . . 0.0 111.33 179.622 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -79.49 -36.89 37.97 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.755 -1.216 . . . . 0.0 110.144 179.026 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -112.78 31.41 6.4 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.172 -0.955 . . . . 0.0 110.984 179.833 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.5 t90 -84.33 -38.94 19.75 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.085 -1.01 . . . . 0.0 110.219 179.925 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.446 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -153.72 -65.26 0.15 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.121 -0.987 . . . . 0.0 110.674 179.983 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.4 -164.64 1.51 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.19 -0.944 . . . . 0.0 110.15 -179.736 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -112.58 39.01 2.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.191 -0.943 . . . . 0.0 110.303 179.877 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -151.17 73.73 1.11 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.167 -0.958 . . . . 0.0 110.43 179.874 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.11 70.64 1.37 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.219 -0.926 . . . . 0.0 110.217 -179.945 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.85 34.56 4.75 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.224 -0.922 . . . . 0.0 110.516 179.646 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.4 m -107.28 -53.05 2.67 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.152 -0.967 . . . . 0.0 109.243 179.184 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.04 -21.37 63.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.244 -0.91 . . . . 0.0 111.225 179.203 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.728 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.56 -54.87 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.604 -1.31 . . . . 0.0 109.534 179.603 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.61 -40.97 93.8 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.69 -35.82 73.24 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.175 -0.953 . . . . 0.0 110.333 179.782 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m . . . . . 0 N--CA 1.506 2.347 0 O-C-N 120.995 -1.065 . . . . 0.0 110.308 179.717 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.461 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 16.2 mtmm . . . . . 0 N--CA 1.503 2.183 0 CA-C-O 120.877 0.37 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.462 ' CD1' HD13 ' A' ' 13' ' ' LEU . 63.7 t80 -54.0 159.16 1.86 Allowed 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.083 -1.01 . . . . 0.0 111.049 -179.493 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -141.71 130.91 23.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.887 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.5 t -113.39 92.36 3.97 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.095 -1.003 . . . . 0.0 110.449 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -53.57 -35.69 61.07 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.024 -1.048 . . . . 0.0 110.233 179.482 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 34' ' ' VAL . 86.0 m-85 -59.75 -35.42 74.54 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.134 -0.979 . . . . 0.0 109.975 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.3 m -93.54 1.08 56.85 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.186 -0.946 . . . . 0.0 112.075 179.971 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.1 38.34 23.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.453 -1.404 . . . . 0.0 110.749 -179.843 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -141.17 168.42 19.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.203 -0.936 . . . . 0.0 110.147 179.908 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 33.0 t80 -122.84 133.0 54.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.302 -0.874 . . . . 0.0 110.307 -179.739 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 13' ' ' LEU . 6.1 mp -89.23 163.85 15.22 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.11 -0.994 . . . . 0.0 109.721 179.591 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -99.56 -30.81 11.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.081 -1.012 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 44.1 m-70 -114.85 136.1 53.46 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.79 -1.194 . . . . 0.0 110.231 -179.858 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -112.92 92.85 4.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.219 -0.926 . . . . 0.0 109.826 179.75 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.85 178.77 1.51 Allowed Pre-proline 0 N--CA 1.494 1.732 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.715 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.62 -29.58 19.54 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 O-C-N 123.377 1.199 . . . . 0.0 111.137 -179.91 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -88.91 -43.56 11.09 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.948 -1.095 . . . . 0.0 109.936 179.538 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -59.83 -52.65 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.762 179.756 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.433 ' HG2' ' CG ' ' A' ' 4' ' ' PHE . 31.2 mtp-105 -58.03 -49.9 75.27 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.122 -0.986 . . . . 0.0 109.546 179.784 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -61.54 -40.35 94.35 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.841 178.689 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.1 m -54.25 -42.71 70.21 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.105 -0.997 . . . . 0.0 108.639 178.407 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -63.14 -38.65 92.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.606 -0.838 . . . . 0.0 109.075 178.198 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -95.2 53.4 1.52 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.221 -0.924 . . . . 0.0 110.457 -179.702 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.79 40.28 2.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.168 -0.957 . . . . 0.0 109.782 179.618 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.21 147.41 19.19 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 -179.74 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -79.93 -10.36 59.77 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.224 -1.163 . . . . 0.0 111.047 178.864 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -90.54 -19.36 23.86 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.632 -1.293 . . . . 0.0 111.467 179.657 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.6 t-80 -48.63 -40.32 27.26 Favored 'General case' 0 N--CA 1.517 2.925 0 O-C-N 120.681 -1.262 . . . . 0.0 110.907 -179.758 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.15 -52.81 57.25 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.743 179.118 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.29 -38.93 88.56 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.235 -0.915 . . . . 0.0 108.987 178.452 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -55.43 -37.79 68.14 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 8' ' ' TYR . 60.9 t -57.87 -37.49 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.139 -0.976 . . . . 0.0 109.788 179.576 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 27.3 tttt -54.42 -41.11 68.96 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.874 -1.141 . . . . 0.0 109.763 179.38 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.5 -27.95 64.94 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.366 178.961 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -71.35 -53.02 15.56 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.897 -1.127 . . . . 0.0 110.089 179.983 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.85 33.68 2.49 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.151 -0.968 . . . . 0.0 111.256 179.624 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -81.67 -37.25 27.73 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.767 -1.208 . . . . 0.0 110.145 179.027 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -100.06 20.92 13.58 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.195 -0.941 . . . . 0.0 111.212 179.332 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.623 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 15.0 t90 -102.6 -48.62 4.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.837 -1.165 . . . . 0.0 109.951 179.77 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.623 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -124.98 -58.13 1.48 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.24 -0.912 . . . . 0.0 109.997 179.725 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 54.0 38.73 29.51 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.922 -1.111 . . . . 0.0 110.822 179.998 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -145.87 -61.38 0.33 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.169 -0.957 . . . . 0.0 110.156 179.863 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -151.24 74.91 1.16 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.158 -0.964 . . . . 0.0 110.459 179.845 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.25 71.36 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.193 -0.942 . . . . 0.0 110.469 -179.824 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -123.32 32.33 5.69 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.223 -0.923 . . . . 0.0 110.689 179.364 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.02 -48.25 3.94 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.082 -1.011 . . . . 0.0 109.687 179.271 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -21.23 62.33 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.197 -0.94 . . . . 0.0 111.492 179.342 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.716 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -80.85 -40.2 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.666 -1.272 . . . . 0.0 110.001 179.861 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -80.43 -40.98 25.32 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.194 -0.941 . . . . 0.0 109.897 179.791 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -33.27 69.34 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.21 -0.931 . . . . 0.0 110.558 179.751 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.504 2.245 0 O-C-N 120.944 -1.097 . . . . 0.0 110.489 -179.982 . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 15.8 mmtt . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 . . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.488 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.0 t80 -114.57 161.89 17.46 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.992 179.689 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -142.78 131.34 22.45 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.251 -0.906 . . . . 0.0 110.223 -179.457 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.7 t -108.08 92.25 3.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.132 -0.98 . . . . 0.0 110.012 179.339 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -51.44 -35.54 39.95 Favored 'General case' 0 N--CA 1.515 2.824 0 O-C-N 121.151 -0.968 . . . . 0.0 110.539 -179.989 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.888 ' CD2' HG13 ' A' ' 34' ' ' VAL . 79.6 m-85 -61.62 -31.04 71.1 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.059 -1.025 . . . . 0.0 110.144 179.068 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.4 m -100.8 -4.21 28.43 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.936 -1.102 . . . . 0.0 112.334 -179.856 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 t70 54.21 38.68 29.73 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.347 -1.471 . . . . 0.0 110.453 -179.614 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -137.03 169.78 17.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.218 -0.926 . . . . 0.0 109.745 179.785 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 13.9 t80 -119.34 139.54 51.8 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.207 -0.933 . . . . 0.0 110.641 -179.549 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.488 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -104.01 155.83 18.35 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.287 -0.883 . . . . 0.0 109.471 179.396 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.403 ' HA ' ' CD ' ' A' ' 3' ' ' LYS . 13.4 t -103.56 -29.43 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.076 -1.015 . . . . 0.0 112.293 -179.122 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.506 ' CB ' HG21 ' A' ' 20' ' ' VAL . 34.7 m170 -109.62 86.53 2.31 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.778 -1.201 . . . . 0.0 110.481 -179.734 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -73.78 71.08 1.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.24 -0.913 . . . . 0.0 110.169 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -114.45 179.77 0.73 Allowed Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 109.934 179.965 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.7 -31.35 13.32 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.292 1.154 . . . . 0.0 111.067 -179.915 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.5 m -85.53 -46.49 10.79 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.943 -1.098 . . . . 0.0 109.832 179.58 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' A' ' 15' ' ' HIS . 84.6 t -59.06 -52.26 62.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.089 -1.007 . . . . 0.0 109.719 179.802 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 3.1 mtt180 -56.7 -51.44 68.8 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.097 -1.002 . . . . 0.0 109.696 179.842 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -61.6 -40.49 95.0 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.766 178.816 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -55.16 -43.43 74.27 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.056 -1.027 . . . . 0.0 108.408 178.273 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.029 178.052 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -97.8 47.53 1.01 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.241 -0.912 . . . . 0.0 110.513 -179.697 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -116.21 40.23 2.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.139 -0.976 . . . . 0.0 109.815 179.493 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.11 150.36 20.16 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -179.705 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -81.14 -10.04 59.71 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.232 -1.157 . . . . 0.0 111.031 178.844 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mttp -90.46 -21.55 21.82 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.7 -1.25 . . . . 0.0 111.408 179.602 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.2 t-80 -48.33 -37.55 16.85 Favored 'General case' 0 N--CA 1.518 2.97 0 O-C-N 120.806 -1.184 . . . . 0.0 110.998 -179.735 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -63.79 -54.44 35.08 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -60.4 -39.47 87.45 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.273 -0.892 . . . . 0.0 108.968 178.748 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -55.68 -37.41 68.29 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.224 -0.923 . . . . 0.0 110.11 179.158 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.888 HG13 ' CD2' ' A' ' 8' ' ' TYR . 53.0 t -55.67 -35.34 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.015 -1.053 . . . . 0.0 110.222 179.74 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 62.8 tttt -53.1 -41.33 64.85 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.876 -1.14 . . . . 0.0 110.025 179.659 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.67 -28.91 66.18 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.296 -0.877 . . . . 0.0 110.382 178.952 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -68.45 -51.75 40.22 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 120.895 -1.128 . . . . 0.0 110.368 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.1 p90 -100.07 35.55 2.04 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.016 -1.053 . . . . 0.0 111.196 179.753 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -39.23 12.94 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.88 -1.138 . . . . 0.0 109.843 178.72 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -111.65 31.01 6.47 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.297 -0.877 . . . . 0.0 110.639 179.378 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.43 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.3 t90 -94.62 -40.26 9.92 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.082 -1.011 . . . . 0.0 110.152 -179.901 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.43 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -148.47 -63.89 0.25 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 179.954 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -146.79 -164.56 2.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.119 -0.988 . . . . 0.0 110.199 -179.908 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -111.39 39.76 2.24 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.137 -0.977 . . . . 0.0 110.143 179.884 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -144.54 74.45 1.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.233 -0.917 . . . . 0.0 110.216 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.44 71.81 1.3 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.194 -0.941 . . . . 0.0 110.355 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -114.7 35.02 4.45 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.22 -0.925 . . . . 0.0 110.493 179.663 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.2 p -108.37 -53.12 2.67 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.084 -1.01 . . . . 0.0 109.419 179.315 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -20.68 63.98 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.154 -0.966 . . . . 0.0 111.35 179.39 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.792 HD12 HG11 ' A' ' 34' ' ' VAL . 49.6 mm -74.82 -44.08 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.557 -1.339 . . . . 0.0 109.685 179.791 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.84 -41.46 95.86 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.193 -0.942 . . . . 0.0 109.826 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -59.8 -36.22 76.31 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.262 179.872 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.505 2.278 0 O-C-N 121.058 -1.026 . . . . 0.0 110.329 179.743 . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 N--CA 1.5 2.054 0 CA-C-O 120.852 0.358 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.598 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.4 t80 -130.51 162.28 29.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.048 -1.033 . . . . 0.0 110.013 -179.683 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 33.4 t80 -135.52 132.65 37.55 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.177 -0.952 . . . . 0.0 110.532 -179.583 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.7 t -110.65 90.09 3.23 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.214 -0.929 . . . . 0.0 109.633 179.248 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -50.06 -34.92 23.17 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.131 -0.981 . . . . 0.0 111.197 -179.603 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.927 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.2 m-85 -64.17 -32.24 73.74 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.848 179.526 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 43.7 m -95.98 -6.36 39.08 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.971 -1.081 . . . . 0.0 112.041 179.696 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 t70 55.81 39.68 30.71 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.447 -1.408 . . . . 0.0 110.352 -179.456 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -140.24 169.68 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 109.79 179.82 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -120.55 144.56 48.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.148 -0.97 . . . . 0.0 110.563 -179.685 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.598 HD13 ' HD1' ' A' ' 4' ' ' PHE . 6.4 mp -102.97 166.42 10.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.16 -0.962 . . . . 0.0 109.771 179.543 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.404 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.0 t -104.41 -29.96 10.38 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.103 -0.998 . . . . 0.0 112.285 -179.17 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.74 ' O ' HG11 ' A' ' 20' ' ' VAL . 33.4 m170 -112.68 124.19 52.0 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.7 -1.25 . . . . 0.0 110.451 -179.577 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -98.69 64.95 1.53 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.107 -0.996 . . . . 0.0 110.408 179.907 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.78 178.36 0.98 Allowed Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.214 -0.929 . . . . 0.0 109.96 179.825 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.07 -35.94 6.44 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.359 1.189 . . . . 0.0 110.736 -179.939 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.3 t -76.23 -39.54 54.27 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.063 -1.023 . . . . 0.0 110.011 179.711 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.74 HG11 ' O ' ' A' ' 15' ' ' HIS . 98.6 t -58.94 -54.53 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.112 -0.993 . . . . 0.0 109.856 179.923 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -55.37 -50.85 68.63 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.054 -1.029 . . . . 0.0 109.793 179.946 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -62.0 -40.85 97.06 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.797 178.77 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.3 m -56.43 -44.17 80.16 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.082 -1.011 . . . . 0.0 108.318 178.324 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -63.21 -38.29 90.6 Favored 'General case' 0 N--CA 1.503 2.192 0 C-N-CA 119.66 -0.816 . . . . 0.0 108.869 178.11 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.9 t -94.34 55.1 1.95 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.307 -0.871 . . . . 0.0 110.206 -179.988 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -114.85 39.84 2.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 110.005 179.759 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -138.52 152.14 21.89 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -81.22 -11.96 59.27 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.238 -1.154 . . . . 0.0 111.183 179.053 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -90.99 -20.92 21.59 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.694 -1.254 . . . . 0.0 111.456 179.704 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.7 t-80 -49.0 -42.39 37.73 Favored 'General case' 0 N--CA 1.518 2.929 0 O-C-N 120.715 -1.24 . . . . 0.0 111.007 -179.627 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 mtmt -62.52 -55.05 31.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.129 -0.982 . . . . 0.0 109.019 179.356 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -38.48 83.03 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.15 178.612 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.08 -39.65 75.39 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.274 -0.891 . . . . 0.0 109.935 179.359 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.927 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.9 t -62.71 -36.2 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.174 -0.954 . . . . 0.0 109.823 179.476 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.2 ttpp -52.33 -39.86 61.2 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 120.998 -1.064 . . . . 0.0 110.079 179.444 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.64 -32.13 68.77 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.195 178.985 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -66.65 -52.42 45.12 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.86 -1.15 . . . . 0.0 110.144 179.933 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.1 33.59 2.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.087 -1.008 . . . . 0.0 111.297 179.592 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -36.41 39.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.783 -1.198 . . . . 0.0 110.163 179.006 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -111.13 30.05 7.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.16 -0.963 . . . . 0.0 110.969 179.701 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 26.2 t90 -92.53 -39.79 11.17 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.119 -0.988 . . . . 0.0 110.124 179.888 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.6 tpp -143.65 -59.95 0.4 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.115 -0.991 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -151.99 -170.32 3.61 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.211 -0.93 . . . . 0.0 110.392 -179.803 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -106.29 52.77 0.72 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.1 -1.0 . . . . 0.0 110.157 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -166.36 73.47 0.16 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.187 -0.945 . . . . 0.0 110.775 179.962 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -146.14 72.07 1.28 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.266 -0.897 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -110.93 36.08 3.28 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.238 -0.914 . . . . 0.0 110.32 179.573 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -110.4 -54.07 2.62 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.151 -0.968 . . . . 0.0 109.617 179.436 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.87 -21.41 63.25 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.244 -0.91 . . . . 0.0 111.458 179.508 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 46.7 mm -70.5 -40.86 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.569 -1.332 . . . . 0.0 109.672 179.651 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -34.83 79.31 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.147 -0.971 . . . . 0.0 110.474 179.838 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -90.08 -39.36 12.94 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.034 -1.041 . . . . 0.0 110.403 179.895 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.3 m . . . . . 0 N--CA 1.508 2.449 0 O-C-N 121.13 -0.981 . . . . 0.0 110.005 179.897 . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.447 ' HB2' ' CZ ' ' A' ' 12' ' ' TYR . 46.9 mttt . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.656 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.0 t80 -112.4 161.9 16.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.9 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -131.28 138.28 49.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.165 -0.96 . . . . 0.0 110.401 -179.719 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.5 t -116.83 96.95 5.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.156 -0.965 . . . . 0.0 109.955 179.46 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -51.53 -35.63 41.47 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.014 -1.054 . . . . 0.0 110.658 -179.991 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.669 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.8 m-85 -63.14 -31.07 72.12 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.132 -0.98 . . . . 0.0 110.202 179.252 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 51.7 m -100.07 -10.14 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.972 -1.08 . . . . 0.0 112.055 -179.939 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t0 56.39 40.76 29.6 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.405 -1.434 . . . . 0.0 110.167 -179.464 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -141.76 172.49 12.61 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.221 -0.924 . . . . 0.0 109.985 179.944 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.447 ' CZ ' ' HB2' ' A' ' 3' ' ' LYS . 5.0 t80 -119.96 135.1 55.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.17 -0.956 . . . . 0.0 110.575 -179.72 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.656 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.7 mp -91.48 170.28 10.08 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.234 -0.916 . . . . 0.0 109.687 179.537 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.451 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.7 t -97.58 -31.68 12.19 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.175 -0.953 . . . . 0.0 111.388 -179.717 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.451 ' CG ' HG23 ' A' ' 14' ' ' THR . 30.6 m170 -116.05 135.86 53.56 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.849 -1.157 . . . . 0.0 110.125 179.989 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.01 95.85 5.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.149 -0.969 . . . . 0.0 109.882 179.822 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.73 177.74 1.68 Allowed Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.905 . . . . 0.0 110.247 -179.603 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.5 -32.15 16.01 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.398 1.209 . . . . 0.0 110.969 179.824 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 26.8 m -85.11 -40.26 16.97 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.933 -1.105 . . . . 0.0 109.979 179.562 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -63.18 -49.52 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.135 -0.978 . . . . 0.0 109.688 179.793 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.6 mtm-85 -55.93 -52.14 65.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.061 -1.024 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -61.15 -40.28 93.26 Favored 'General case' 0 N--CA 1.509 2.48 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.883 178.811 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.9 m -55.49 -43.44 75.61 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.085 -1.009 . . . . 0.0 108.368 178.345 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -62.17 -38.8 90.42 Favored 'General case' 0 N--CA 1.504 2.227 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 177.974 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.5 t -95.83 52.34 1.32 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.218 -0.926 . . . . 0.0 110.373 -179.89 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -120.0 37.36 4.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.094 -1.003 . . . . 0.0 110.256 179.775 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.07 128.53 3.45 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.948 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -54.03 -28.89 41.2 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.168 -1.195 . . . . 0.0 110.423 179.199 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -59.75 -35.39 74.49 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.958 -1.089 . . . . 0.0 110.352 179.906 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.3 t-80 -51.25 -38.98 55.66 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.925 -1.11 . . . . 0.0 110.61 -179.611 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -62.18 -55.42 28.8 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.164 -0.96 . . . . 0.0 109.131 179.381 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -59.36 -39.45 83.32 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.249 -0.907 . . . . 0.0 109.124 178.766 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -56.44 -38.39 71.55 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.317 -0.864 . . . . 0.0 109.97 179.252 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.791 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -58.92 -37.11 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.15 -0.969 . . . . 0.0 109.952 179.743 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 31.2 mtmt -53.37 -41.46 65.87 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.969 -1.082 . . . . 0.0 109.863 179.768 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -58.38 -32.37 68.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.311 -0.868 . . . . 0.0 110.152 178.891 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -63.48 -51.31 66.13 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.027 -1.046 . . . . 0.0 110.151 179.935 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.585 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.7 p90 -100.66 36.27 1.96 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.09 -1.006 . . . . 0.0 111.151 179.62 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.15 -37.79 14.78 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.882 -1.137 . . . . 0.0 110.131 178.887 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.96 27.96 9.07 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.194 -0.941 . . . . 0.0 111.014 179.568 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.0 t90 -92.81 -40.49 10.62 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.989 -1.069 . . . . 0.0 110.198 179.921 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.435 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -149.18 -63.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.097 -1.002 . . . . 0.0 110.502 179.954 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.54 2.18 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.207 -0.933 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -109.8 39.42 2.13 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -0.98 . . . . 0.0 110.259 179.787 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -148.45 75.69 1.33 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.157 -0.964 . . . . 0.0 110.299 179.885 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.9 74.67 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.294 -0.879 . . . . 0.0 110.251 -179.836 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.91 35.01 3.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.173 -0.955 . . . . 0.0 110.46 179.611 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.3 p -109.16 -54.75 2.5 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.084 -1.01 . . . . 0.0 109.189 179.152 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -20.51 65.0 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.283 -0.885 . . . . 0.0 111.175 179.154 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.791 HD12 HG11 ' A' ' 34' ' ' VAL . 49.7 mm -75.24 -40.22 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.67 -1.269 . . . . 0.0 109.837 179.778 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -40.42 73.33 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.175 -0.953 . . . . 0.0 109.957 179.942 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -58.2 -35.66 71.97 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.252 -0.905 . . . . 0.0 110.488 179.967 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.0 m . . . . . 0 N--CA 1.503 2.216 0 O-C-N 121.091 -1.006 . . . . 0.0 110.155 179.848 . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.595 ' HD2' HD13 ' A' ' 13' ' ' LEU . 87.1 t80 -113.31 161.77 16.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.065 -1.022 . . . . 0.0 109.998 179.93 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -137.76 133.66 34.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.272 -0.892 . . . . 0.0 110.278 -179.687 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 t -114.45 98.18 6.75 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.201 -0.937 . . . . 0.0 109.718 179.382 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -56.32 -36.96 69.31 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.101 -0.999 . . . . 0.0 110.758 -179.434 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.966 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -61.93 -32.66 73.08 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.953 -1.092 . . . . 0.0 110.169 179.555 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.8 m -93.31 -6.15 48.07 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.95 -1.094 . . . . 0.0 111.897 179.456 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.71 39.48 31.34 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.443 -1.41 . . . . 0.0 110.437 -179.688 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -142.12 168.08 20.59 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.253 -0.905 . . . . 0.0 109.895 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -118.23 139.99 50.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.571 -179.706 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.595 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.9 mp -97.62 166.3 11.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.24 -0.912 . . . . 0.0 109.657 179.565 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.511 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.91 -30.63 11.55 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.128 -0.983 . . . . 0.0 111.881 -179.452 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.511 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.9 m-70 -118.11 134.98 54.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.799 -1.188 . . . . 0.0 110.226 -179.871 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -112.3 96.73 6.18 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.198 -0.939 . . . . 0.0 109.818 179.685 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -142.52 177.9 1.69 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 -179.568 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -69.87 -29.95 22.54 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.416 1.219 . . . . 0.0 111.039 179.827 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 t -88.72 -44.04 10.85 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.927 -1.108 . . . . 0.0 109.867 179.396 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.405 HG11 ' O ' ' A' ' 15' ' ' HIS . 89.7 t -61.2 -48.96 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.562 0 O-C-N 121.196 -0.94 . . . . 0.0 109.468 179.574 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -59.15 -50.65 73.22 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 109.25 179.541 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -61.7 -40.37 94.79 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.2 -0.937 . . . . 0.0 108.788 178.7 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 88.2 m -54.66 -43.57 72.52 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.042 -1.036 . . . . 0.0 108.455 178.292 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -63.38 -40.36 97.04 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.949 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -94.36 55.7 2.03 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.29 -0.881 . . . . 0.0 110.097 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.95 37.5 3.63 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.18 -0.95 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.08 125.62 2.14 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -179.952 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ttp85 -54.28 -28.34 41.32 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.207 -1.172 . . . . 0.0 110.436 179.157 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -61.22 -31.57 71.35 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.949 -1.094 . . . . 0.0 110.626 179.882 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.8 t-80 -49.35 -38.82 29.54 Favored 'General case' 0 N--CA 1.515 2.782 0 O-C-N 120.903 -1.123 . . . . 0.0 110.937 -179.503 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -63.73 -55.2 25.02 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.101 -1.0 . . . . 0.0 109.039 179.339 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -60.33 -38.99 85.46 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.136 178.682 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -57.16 -36.81 71.22 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.215 -0.928 . . . . 0.0 110.222 179.27 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.966 HG13 ' CD1' ' A' ' 8' ' ' TYR . 97.3 t -58.04 -38.69 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.069 -1.019 . . . . 0.0 109.908 179.898 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 11.3 mttt -58.59 -42.09 87.3 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.009 -1.057 . . . . 0.0 109.454 179.227 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -59.48 -31.15 69.08 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.035 178.805 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 51.2 t80 -67.36 -51.54 50.92 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.012 -1.055 . . . . 0.0 110.346 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.714 ' HE1' HG12 ' A' ' 34' ' ' VAL . 42.4 p90 -99.25 29.84 3.76 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.036 -1.04 . . . . 0.0 111.695 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -78.37 -39.75 38.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.652 -1.28 . . . . 0.0 109.732 178.666 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -115.36 36.87 3.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 179.41 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.9 t90 -92.26 -38.5 12.05 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.175 -0.953 . . . . 0.0 110.19 -179.771 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -147.11 -65.51 0.27 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.16 -0.962 . . . . 0.0 110.347 179.89 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.89 -163.11 1.66 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.205 -0.934 . . . . 0.0 110.152 -179.878 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -103.66 -177.5 3.39 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.104 -0.998 . . . . 0.0 110.073 179.791 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 53.28 74.54 0.3 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.025 -1.047 . . . . 0.0 110.608 -179.743 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.41 70.15 1.42 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.247 -0.908 . . . . 0.0 110.166 -179.967 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.64 33.61 5.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.254 -0.904 . . . . 0.0 110.629 179.595 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.96 -53.04 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.022 -1.049 . . . . 0.0 109.009 179.032 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.8 -20.54 65.12 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.331 -0.855 . . . . 0.0 111.181 178.943 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.722 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -81.53 -55.52 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 120.724 -1.235 . . . . 0.0 109.803 179.714 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -54.64 -38.97 67.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.552 -179.833 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.93 -36.69 82.12 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 179.975 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.503 2.218 0 O-C-N 121.026 -1.046 . . . . 0.0 110.379 179.916 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.98 171.29 17.81 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.438 1.231 . . . . 0.0 110.448 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.409 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 22.4 mttt 61.27 140.53 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.3 -0.875 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.57 ' HD2' HD13 ' A' ' 13' ' ' LEU . 62.4 t80 -112.71 157.71 20.95 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.99 -1.069 . . . . 0.0 109.979 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -136.36 140.22 43.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.187 -0.946 . . . . 0.0 110.471 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.7 t -110.45 97.41 6.86 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.134 -0.979 . . . . 0.0 110.136 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -52.36 -35.87 52.32 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.036 -1.04 . . . . 0.0 110.534 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.83 ' CD1' HG13 ' A' ' 34' ' ' VAL . 93.2 m-85 -62.67 -33.06 74.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.135 -0.978 . . . . 0.0 110.243 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.3 m -100.11 -3.05 32.65 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.028 -1.045 . . . . 0.0 112.282 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 53.24 38.3 27.3 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.409 -1.432 . . . . 0.0 110.75 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 t -129.32 173.53 10.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.158 -0.964 . . . . 0.0 110.03 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.409 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -123.69 108.68 12.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 110.099 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.57 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.7 mp -69.57 157.08 37.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.147 -0.971 . . . . 0.0 109.905 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.408 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.7 t -101.95 -31.15 10.82 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.21 -0.931 . . . . 0.0 111.875 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.534 ' O ' HG11 ' A' ' 20' ' ' VAL . 32.6 m170 -112.03 98.47 7.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.744 -1.223 . . . . 0.0 110.33 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.36 71.06 9.42 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.232 -0.918 . . . . 0.0 110.429 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -110.33 179.87 0.76 Allowed Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.085 -1.009 . . . . 0.0 109.908 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 45.3 Cg_endo -72.81 -30.13 11.76 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.303 1.159 . . . . 0.0 111.421 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -89.84 -40.88 12.15 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.929 -1.107 . . . . 0.0 110.088 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.534 HG11 ' O ' ' A' ' 15' ' ' HIS . 77.8 t -58.67 -50.52 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.123 -0.986 . . . . 0.0 109.759 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -57.56 -51.58 68.88 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.098 -1.001 . . . . 0.0 109.628 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -62.1 -41.09 97.86 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.828 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -54.83 -42.97 72.56 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.137 -0.977 . . . . 0.0 108.552 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.37 -36.12 81.27 Favored 'General case' 0 N--CA 1.503 2.215 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.161 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -99.4 44.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.121 -0.987 . . . . 0.0 110.573 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.55 38.19 3.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.106 -0.996 . . . . 0.0 110.137 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.1 127.28 3.06 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -54.41 -28.29 42.72 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.209 -1.171 . . . . 0.0 110.338 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -60.66 -32.18 71.38 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.994 -1.066 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.541 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.0 t-80 -49.8 -37.14 28.88 Favored 'General case' 0 N--CA 1.518 2.939 0 O-C-N 120.884 -1.135 . . . . 0.0 110.914 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -61.83 -55.62 27.94 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.11 -0.994 . . . . 0.0 109.23 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.63 -38.83 82.43 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.189 -0.944 . . . . 0.0 109.193 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -55.95 -37.27 68.77 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.153 -0.967 . . . . 0.0 110.13 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.83 HG13 ' CD1' ' A' ' 8' ' ' TYR . 75.8 t -56.15 -35.26 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 121.021 -1.049 . . . . 0.0 110.186 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 35.7 tttt -53.38 -41.51 65.98 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.875 -1.14 . . . . 0.0 109.93 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.4 -29.32 65.96 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -70.92 -52.26 21.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.876 -1.14 . . . . 0.0 110.321 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.9 p90 -99.61 33.79 2.41 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.013 -1.055 . . . . 0.0 111.406 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -79.86 -38.15 33.4 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.754 -1.216 . . . . 0.0 110.171 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -116.5 26.36 9.94 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.244 -0.91 . . . . 0.0 111.372 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.63 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 13.0 t90 -56.09 -43.14 77.75 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.873 -1.142 . . . . 0.0 110.218 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.63 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 19.8 ptp -152.75 38.59 0.53 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.156 -0.965 . . . . 0.0 110.74 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 51.31 39.74 24.73 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.02 -1.05 . . . . 0.0 110.965 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -144.43 -165.63 2.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.155 -0.966 . . . . 0.0 110.304 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -117.29 123.98 47.88 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.221 -0.924 . . . . 0.0 110.253 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.404 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -129.91 79.04 1.88 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.418 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 4.1 tt0 -109.34 36.33 2.96 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.11 -0.994 . . . . 0.0 110.463 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.4 t -114.65 -54.98 2.53 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.124 -0.985 . . . . 0.0 109.793 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -22.46 60.74 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 111.479 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.582 HD12 HG11 ' A' ' 34' ' ' VAL . 42.3 mm -65.15 -51.38 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 O-C-N 120.648 -1.282 . . . . 0.0 109.367 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.8 OUTLIER -56.2 -39.27 72.17 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.104 -0.997 . . . . 0.0 110.406 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.769 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 6.2 tptt -62.98 -36.01 82.09 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.211 -0.93 . . . . 0.0 110.517 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.0 m -90.12 -38.72 13.33 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.069 -1.019 . . . . 0.0 110.16 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.405 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 61.6 p -68.07 -36.19 79.42 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.136 -0.977 . . . . 0.0 110.227 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.03 -43.78 9.72 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.045 -1.034 . . . . 0.0 110.112 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.57 53.7 1.49 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.064 -1.023 . . . . 0.0 110.435 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -91.53 -57.86 2.62 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.232 -0.918 . . . . 0.0 110.107 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -150.78 -57.83 0.17 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -0.977 . . . . 0.0 110.519 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -128.58 68.09 1.38 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.166 -0.959 . . . . 0.0 110.178 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -127.02 63.43 0.6 Allowed Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.073 -1.251 . . . . 0.0 110.69 -179.98 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 tpp . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.99 166.34 30.31 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.417 1.22 . . . . 0.0 110.347 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 0.4 OUTLIER 60.9 122.24 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.208 -0.933 . . . . 0.0 110.754 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 52.7 t80 -104.64 156.43 17.98 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.998 -1.064 . . . . 0.0 110.038 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -127.46 137.41 52.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.149 -0.969 . . . . 0.0 110.412 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.35 97.98 6.65 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -54.77 -36.36 64.79 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.056 -1.027 . . . . 0.0 110.284 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.806 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.3 m-85 -60.26 -32.84 71.55 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.029 -1.045 . . . . 0.0 110.111 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HB3' HG22 ' A' ' 11' ' ' THR . 35.9 m -95.79 -1.41 49.75 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.037 -1.04 . . . . 0.0 112.033 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t0 52.39 39.02 26.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.428 -1.42 . . . . 0.0 110.574 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.4 t -146.4 171.86 14.38 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.203 -0.936 . . . . 0.0 110.098 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.2 OUTLIER -120.44 122.61 41.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.15 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -71.34 170.72 12.55 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.174 -0.954 . . . . 0.0 109.826 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.453 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.3 t -100.22 -29.89 12.21 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.296 -0.877 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.656 ' HB2' HG11 ' A' ' 20' ' ' VAL . 39.4 m-70 -113.25 147.66 37.1 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.696 -1.252 . . . . 0.0 110.404 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -123.62 94.58 4.28 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.28 -0.888 . . . . 0.0 109.9 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.12 177.67 1.72 Allowed Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.258 -0.901 . . . . 0.0 110.212 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.4 Cg_endo -70.97 -31.94 14.34 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 O-C-N 123.435 1.229 . . . . 0.0 110.933 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -89.28 -39.62 13.36 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.014 -1.054 . . . . 0.0 110.073 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.43 -46.54 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.067 -1.021 . . . . 0.0 109.692 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 15.3 mtp180 -60.55 -49.46 77.47 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.084 -1.01 . . . . 0.0 109.574 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttt -62.28 -41.15 98.24 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.891 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.2 m -54.58 -42.28 70.87 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.087 -1.008 . . . . 0.0 108.442 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.35 -35.26 79.79 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.394 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -100.18 43.54 1.05 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.123 -0.985 . . . . 0.0 110.56 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -114.93 40.39 2.64 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.09 -1.006 . . . . 0.0 109.824 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -131.38 157.04 22.13 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 ttm-85 -85.51 -10.13 56.45 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.254 -1.145 . . . . 0.0 111.026 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -90.53 -26.01 19.95 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.691 -1.255 . . . . 0.0 111.11 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.0 t-80 -49.76 -38.88 35.74 Favored 'General case' 0 N--CA 1.517 2.916 0 O-C-N 120.814 -1.179 . . . . 0.0 110.574 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -64.58 -53.72 43.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.816 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.09 -39.97 91.94 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.196 -0.94 . . . . 0.0 108.999 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -56.53 -37.88 71.08 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.205 -0.935 . . . . 0.0 110.031 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HD12 ' A' ' 50' ' ' ILE . 93.5 t -57.66 -33.73 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.125 -0.984 . . . . 0.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.0 tttt -52.24 -42.26 63.45 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.87 -1.144 . . . . 0.0 109.849 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.08 -29.53 63.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.336 -0.852 . . . . 0.0 110.375 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -69.38 -52.02 31.08 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.942 -1.099 . . . . 0.0 110.319 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.7 p90 -99.72 35.0 2.1 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.077 -1.014 . . . . 0.0 111.382 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -88.11 -38.34 15.47 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.807 -1.183 . . . . 0.0 109.884 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -112.91 31.58 6.3 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 110.765 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -92.85 -41.7 9.93 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.142 -0.974 . . . . 0.0 110.026 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.445 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -154.95 -65.76 0.13 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.14 -0.975 . . . . 0.0 110.599 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -126.57 -171.55 2.43 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.965 . . . . 0.0 110.005 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.25 38.81 3.44 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.1 -1.0 . . . . 0.0 110.342 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -152.96 75.23 1.08 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.237 -0.914 . . . . 0.0 110.484 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.55 75.43 1.54 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.199 -0.938 . . . . 0.0 110.224 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -111.36 35.86 3.44 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.095 -1.003 . . . . 0.0 110.435 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.54 -55.47 2.5 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.201 -0.937 . . . . 0.0 109.24 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.98 64.51 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.307 -0.871 . . . . 0.0 111.189 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.815 HD12 HG11 ' A' ' 34' ' ' VAL . 47.8 mm -71.6 -40.27 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.62 -1.3 . . . . 0.0 109.618 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.443 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 10.5 t0 -72.76 -39.83 66.5 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.128 -0.983 . . . . 0.0 110.013 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.765 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 11.6 mmtt -57.02 -36.22 70.18 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.179 -0.951 . . . . 0.0 110.63 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 90.0 m -90.53 -46.69 8.16 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.546 HG23 ' O ' ' A' ' 50' ' ' ILE . 60.0 p -59.71 -35.48 74.6 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.329 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.61 -39.56 12.43 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.073 -1.017 . . . . 0.0 110.391 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.22 47.23 1.03 Allowed 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.111 -0.993 . . . . 0.0 110.736 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -92.61 -40.25 10.87 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.112 -0.993 . . . . 0.0 110.107 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -115.25 41.03 2.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.14 -0.975 . . . . 0.0 110.165 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -129.73 71.52 1.45 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.225 -0.922 . . . . 0.0 110.135 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.29 -78.23 1.38 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.493 1.701 0 O-C-N 121.226 -1.161 . . . . 0.0 110.251 -179.998 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 ttt . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.09 155.06 57.36 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.391 1.206 . . . . 0.0 110.555 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -136.43 149.8 48.43 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.194 -0.941 . . . . 0.0 110.06 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CE1' ' NH2' ' A' ' 21' ' ' ARG . 43.5 t80 -114.36 156.36 24.58 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.244 -0.91 . . . . 0.0 110.01 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -135.43 136.79 41.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.399 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -112.27 95.39 5.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.209 -0.932 . . . . 0.0 110.222 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.94 -36.16 59.55 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 121.026 -1.046 . . . . 0.0 110.383 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.69 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.1 m-85 -60.45 -32.18 71.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.149 -0.97 . . . . 0.0 110.067 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -97.66 -1.54 43.41 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.064 -1.023 . . . . 0.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.92 38.51 27.16 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.377 -1.452 . . . . 0.0 110.567 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -139.5 173.07 11.92 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.162 -0.961 . . . . 0.0 109.964 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.96 119.53 30.69 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.279 -0.888 . . . . 0.0 110.254 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.4 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -78.1 163.98 25.39 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.11 -0.994 . . . . 0.0 109.383 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.508 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -101.05 -21.79 14.91 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.132 -0.98 . . . . 0.0 112.166 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.563 ' HB2' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -120.53 139.6 52.67 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.628 -1.295 . . . . 0.0 110.145 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -120.6 93.19 3.96 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.253 -0.904 . . . . 0.0 109.78 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.404 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -139.51 178.39 1.65 Allowed Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.321 -0.862 . . . . 0.0 109.993 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.1 Cg_endo -70.62 -26.82 23.09 Favored 'Trans proline' 0 C--N 1.315 -1.196 0 O-C-N 123.351 1.185 . . . . 0.0 111.308 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.08 -40.71 9.92 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.893 -1.129 . . . . 0.0 110.16 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 15' ' ' HIS . 83.9 t -60.12 -48.39 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.031 -1.043 . . . . 0.0 109.884 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.421 ' NH2' ' CE1' ' A' ' 4' ' ' PHE . 19.6 mtp180 -56.99 -51.69 68.22 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.132 -0.98 . . . . 0.0 109.86 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -60.18 -40.55 90.38 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.179 -0.95 . . . . 0.0 109.048 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 42.1 m -54.69 -42.92 72.03 Favored 'General case' 0 N--CA 1.513 2.675 0 O-C-N 121.035 -1.041 . . . . 0.0 108.369 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -63.73 -38.61 91.76 Favored 'General case' 0 N--CA 1.502 2.175 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.004 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.02 51.93 1.27 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.298 -0.876 . . . . 0.0 110.488 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 37.69 3.82 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.06 -1.025 . . . . 0.0 110.327 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.68 122.8 1.75 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -50.87 -30.26 14.09 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.118 -1.225 . . . . 0.0 110.847 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -33.16 69.6 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.095 -1.003 . . . . 0.0 110.503 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.06 -38.28 37.37 Favored 'General case' 0 N--CA 1.517 2.887 0 O-C-N 121.016 -1.053 . . . . 0.0 110.694 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -62.55 -53.17 58.71 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.161 -0.962 . . . . 0.0 108.972 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -60.61 -39.66 89.01 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.221 -0.924 . . . . 0.0 109.0 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.13 -38.43 68.21 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.207 -0.933 . . . . 0.0 110.099 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD12 ' A' ' 50' ' ' ILE . 74.6 t -59.27 -37.9 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 109.894 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 1.5 tppp? -56.99 -41.79 79.06 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.973 -1.08 . . . . 0.0 109.509 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.27 -29.81 67.84 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.251 -0.905 . . . . 0.0 110.101 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -68.54 -52.53 30.97 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.957 -1.089 . . . . 0.0 110.28 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.667 ' HE1' HG12 ' A' ' 34' ' ' VAL . 38.1 p90 -98.53 24.82 6.97 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.085 -1.01 . . . . 0.0 111.82 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -65.34 -41.23 94.11 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 120.626 -1.296 . . . . 0.0 109.745 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 mtmt -122.63 26.3 8.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.35 -0.844 . . . . 0.0 111.164 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.0 t90 -64.4 -40.6 96.11 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.888 -1.133 . . . . 0.0 110.219 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.449 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 mtm -156.29 -56.53 0.09 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.138 -0.976 . . . . 0.0 110.845 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -126.08 -171.84 2.48 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.138 -0.976 . . . . 0.0 110.532 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -34.19 11.25 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.158 -0.964 . . . . 0.0 111.015 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -93.32 96.17 9.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.927 -1.108 . . . . 0.0 110.189 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -141.48 71.21 1.35 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -121.18 34.14 5.31 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.21 -0.931 . . . . 0.0 110.635 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -106.76 -51.48 2.93 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.125 -0.984 . . . . 0.0 109.558 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -21.14 62.73 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.215 -0.928 . . . . 0.0 111.499 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.794 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.85 -56.3 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 O-C-N 120.665 -1.272 . . . . 0.0 109.77 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.34 -36.71 71.51 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -73.01 -34.04 66.13 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.647 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.6 m -87.7 -39.69 14.76 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.939 -1.101 . . . . 0.0 110.163 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -55.94 -36.14 67.44 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.514 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.1 -38.35 31.83 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.131 -0.981 . . . . 0.0 110.089 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.89 59.39 3.18 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.096 -1.003 . . . . 0.0 109.923 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -92.03 -41.52 10.48 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.327 -0.858 . . . . 0.0 110.103 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -139.88 40.1 1.99 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.149 -0.969 . . . . 0.0 110.286 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -145.29 81.44 1.63 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.224 -0.923 . . . . 0.0 110.374 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -136.04 44.5 1.16 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt . . . . . 0 N--CA 1.496 1.836 0 O-C-N 121.17 -1.194 . . . . 0.0 110.245 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 ptp . . . . . 0 N--CA 1.499 1.99 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.05 103.15 1.44 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.277 1.146 . . . . 0.0 110.319 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 35.0 mmtm -127.0 145.14 50.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.112 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.689 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.9 t80 -116.26 161.95 18.23 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -132.72 136.15 46.21 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.237 -0.915 . . . . 0.0 110.212 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.39 97.24 6.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.199 -0.938 . . . . 0.0 109.905 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -51.39 -35.57 39.47 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.121 -0.987 . . . . 0.0 110.554 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.534 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.3 m-85 -62.7 -30.8 71.68 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.145 -0.972 . . . . 0.0 110.249 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.3 m -100.02 -8.98 23.2 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.952 -1.093 . . . . 0.0 112.118 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.95 42.44 31.06 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.391 -1.443 . . . . 0.0 110.087 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -145.35 172.43 13.17 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.289 -0.882 . . . . 0.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.457 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 3.5 t80 -118.29 129.49 55.49 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.255 -0.903 . . . . 0.0 110.305 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.689 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.5 mp -85.9 170.2 12.58 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.173 -0.955 . . . . 0.0 109.861 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 3' ' ' LYS . 15.0 t -97.26 -21.96 16.96 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.198 -0.939 . . . . 0.0 111.696 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.792 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.2 m170 -122.16 147.29 46.34 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.619 -1.301 . . . . 0.0 110.097 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -127.08 93.54 3.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.208 -0.933 . . . . 0.0 109.81 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.406 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -148.19 179.1 1.25 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.284 -0.885 . . . . 0.0 110.17 -179.643 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -71.03 -32.09 13.9 Favored 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.326 1.171 . . . . 0.0 110.811 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 -39.72 17.1 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.975 -1.078 . . . . 0.0 109.956 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.792 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.5 t -64.9 -47.12 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 O-C-N 121.11 -0.993 . . . . 0.0 109.678 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.451 ' NH1' ' CD2' ' A' ' 4' ' ' PHE . 11.7 mtp180 -57.61 -51.96 67.39 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.072 -1.017 . . . . 0.0 109.588 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -60.77 -40.36 92.23 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.184 -0.948 . . . . 0.0 108.82 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -55.18 -43.38 74.3 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.141 -0.975 . . . . 0.0 108.546 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.448 ' ND1' HD21 ' A' ' 13' ' ' LEU . 70.8 t60 -61.69 -37.29 83.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.426 -0.796 . . . . 0.0 109.061 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.25 50.06 1.07 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.187 -0.946 . . . . 0.0 110.369 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.71 37.63 3.88 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.051 -1.031 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.68 128.44 3.35 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.2 tpp85 -54.47 -28.52 45.15 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.141 -1.211 . . . . 0.0 110.413 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -59.5 -35.77 74.79 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.977 -1.077 . . . . 0.0 110.355 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.448 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.78 -46.09 64.03 Favored 'General case' 0 N--CA 1.514 2.725 0 O-C-N 120.931 -1.106 . . . . 0.0 110.489 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -54.57 45.59 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.086 -1.009 . . . . 0.0 109.427 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -60.09 -39.47 86.23 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.186 -0.946 . . . . 0.0 109.073 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -56.85 -38.67 73.0 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.948 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.597 HG12 ' HE2' ' A' ' 38' ' ' TYR . 65.9 t -59.06 -38.21 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.554 0 O-C-N 121.139 -0.976 . . . . 0.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 29.3 ttmt -54.97 -40.58 70.16 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.949 -1.095 . . . . 0.0 109.832 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -58.11 -30.16 66.06 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.304 -0.873 . . . . 0.0 110.229 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.24 -53.51 24.15 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.931 -1.106 . . . . 0.0 110.177 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.822 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 39.2 p90 -98.14 22.79 9.01 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.137 -0.977 . . . . 0.0 111.702 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.78 -38.4 90.47 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.593 -1.317 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -113.89 33.28 5.3 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.157 -0.964 . . . . 0.0 110.742 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.478 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 24.5 t90 -92.16 -40.51 10.97 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.19 -0.944 . . . . 0.0 110.151 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.478 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 3.0 ttm -151.78 -62.98 0.17 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.17 -0.956 . . . . 0.0 110.664 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -122.24 -172.9 2.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.0 110.524 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -98.32 -37.35 9.68 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.225 -0.922 . . . . 0.0 110.783 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -105.47 92.81 4.35 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.092 -1.005 . . . . 0.0 110.219 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.822 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -128.52 74.85 1.59 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -0.919 . . . . 0.0 110.13 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.16 35.54 3.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.099 -1.001 . . . . 0.0 110.492 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.0 t -110.5 -54.64 2.56 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.096 -1.002 . . . . 0.0 109.395 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -20.7 64.34 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.25 -0.906 . . . . 0.0 111.393 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.647 ' O ' HG23 ' A' ' 54' ' ' THR . 47.6 mm -72.33 -44.91 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 120.681 -1.262 . . . . 0.0 109.788 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -62.79 -48.59 78.48 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.168 -0.957 . . . . 0.0 109.887 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.681 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 2.1 ttpm? -56.52 -33.48 66.08 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.143 -0.973 . . . . 0.0 110.632 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.3 m -89.93 -37.04 14.66 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.945 -1.097 . . . . 0.0 110.351 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.647 HG23 ' O ' ' A' ' 50' ' ' ILE . 82.8 p -74.42 -35.02 63.38 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.037 -1.04 . . . . 0.0 110.543 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -87.36 -34.67 18.73 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.042 -1.036 . . . . 0.0 110.633 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.87 36.87 1.47 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.945 -1.097 . . . . 0.0 111.343 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -91.51 -45.07 8.72 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.997 -1.064 . . . . 0.0 110.116 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.51 73.8 1.52 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.117 -0.99 . . . . 0.0 110.137 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -116.5 -58.37 2.09 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.177 -0.952 . . . . 0.0 110.255 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -118.99 -103.55 2.1 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.2 mttp . . . . . 0 N--CA 1.494 1.732 0 O-C-N 121.113 -1.228 . . . . 0.0 110.167 179.956 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.57 148.31 47.45 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 O-C-N 123.361 1.19 . . . . 0.0 110.474 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -135.56 156.42 48.91 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.18 -0.95 . . . . 0.0 110.216 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.8 t80 -110.4 161.65 15.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.103 -0.998 . . . . 0.0 110.522 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD2' ' A' ' 4' ' ' PHE . 34.9 t80 -133.7 134.06 42.62 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.252 -0.905 . . . . 0.0 110.115 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.9 t -113.53 96.39 5.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -0.975 . . . . 0.0 110.177 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -53.71 -36.34 62.13 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.388 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.6 m-85 -60.74 -32.4 71.67 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.091 -1.006 . . . . 0.0 110.156 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' HG22 ' A' ' 11' ' ' THR . 33.5 m -96.99 -5.94 36.62 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.076 -1.015 . . . . 0.0 112.116 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 54.75 39.98 31.67 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.349 -1.47 . . . . 0.0 110.23 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.409 HG22 ' HB3' ' A' ' 9' ' ' CYS . 9.1 t -143.42 172.24 13.05 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.236 -0.915 . . . . 0.0 109.918 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -117.34 138.82 51.53 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.271 -0.893 . . . . 0.0 110.469 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.0 mp -97.68 168.42 10.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.222 -0.924 . . . . 0.0 109.769 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.515 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -99.38 -29.07 12.98 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.217 -0.927 . . . . 0.0 111.73 -179.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.71 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.6 m-70 -112.06 148.42 33.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.774 -1.204 . . . . 0.0 110.431 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -126.92 93.93 3.89 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.331 -0.856 . . . . 0.0 109.761 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -150.82 178.52 1.49 Allowed Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.272 -0.893 . . . . 0.0 110.305 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.07 -33.3 11.94 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.354 1.186 . . . . 0.0 110.735 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.7 t -83.16 -38.59 22.15 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.011 -1.056 . . . . 0.0 110.033 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.71 HG11 ' HB2' ' A' ' 15' ' ' HIS . 62.2 t -64.1 -47.38 90.43 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HB3' ' CE1' ' A' ' 57' ' ' PHE . 36.3 mtp180 -57.97 -50.07 74.62 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.097 -1.002 . . . . 0.0 109.53 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.12 -40.99 97.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.214 -0.929 . . . . 0.0 108.655 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -55.48 -43.84 75.92 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.159 -0.963 . . . . 0.0 108.487 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -62.59 -39.49 93.88 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.353 -0.842 . . . . 0.0 108.863 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.5 t -92.42 56.0 2.65 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.278 -0.889 . . . . 0.0 110.335 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -118.5 37.42 4.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.127 -0.983 . . . . 0.0 110.414 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.15 128.27 3.23 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -54.54 -28.18 43.7 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.153 -1.204 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.941 -1.1 . . . . 0.0 110.522 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.454 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.1 t-80 -51.47 -40.66 59.92 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.951 -1.093 . . . . 0.0 110.523 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.2 tttt -62.75 -55.61 25.03 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.196 -0.94 . . . . 0.0 109.064 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -59.34 -38.85 81.38 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.2 -0.938 . . . . 0.0 109.189 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.62 -38.23 71.81 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.8 HG11 HD12 ' A' ' 50' ' ' ILE . 79.5 t -64.46 -39.57 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 O-C-N 121.134 -0.978 . . . . 0.0 109.641 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.3 ttpt -58.38 -42.79 87.86 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.069 -1.019 . . . . 0.0 109.348 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.02 -30.2 67.84 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.529 -0.869 . . . . 0.0 110.283 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -70.41 -51.82 26.81 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.901 -1.125 . . . . 0.0 110.322 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.721 ' HE1' HG12 ' A' ' 34' ' ' VAL . 40.3 p90 -100.03 34.54 2.28 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.13 -0.981 . . . . 0.0 111.295 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -78.3 -39.63 39.2 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.814 -1.179 . . . . 0.0 110.0 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tttm -117.82 22.69 12.15 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.243 -0.91 . . . . 0.0 111.53 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 13.1 t90 -57.61 -55.29 36.75 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.796 -1.19 . . . . 0.0 110.151 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.457 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 13.2 mtt -149.1 -63.1 0.23 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -122.79 -171.95 2.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.161 -0.962 . . . . 0.0 110.06 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -110.76 39.72 2.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.227 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -145.55 75.02 1.41 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.917 . . . . 0.0 110.174 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.46 71.73 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.239 -0.913 . . . . 0.0 110.343 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.76 34.71 5.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.254 -0.904 . . . . 0.0 110.574 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 7.2 p -108.12 -52.57 2.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.056 -1.027 . . . . 0.0 109.418 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.408 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -60.92 -21.12 63.08 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.195 -0.941 . . . . 0.0 111.418 179.376 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.8 HD12 HG11 ' A' ' 34' ' ' VAL . 49.5 mm -76.12 -52.22 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.659 -1.276 . . . . 0.0 109.597 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 26.1 t0 -58.45 -39.39 79.72 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.2 -0.937 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -55.88 -36.34 67.49 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.076 -1.015 . . . . 0.0 110.625 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.1 m -91.69 -45.9 8.2 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.08 -1.013 . . . . 0.0 110.172 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.446 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 77.1 p -62.02 -39.69 93.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.188 -0.945 . . . . 0.0 110.042 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.19 -44.81 92.22 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.123 -0.986 . . . . 0.0 110.155 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.96 -37.12 73.59 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.124 -0.985 . . . . 0.0 110.507 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' A' ' 21' ' ' ARG . 7.0 m-85 -58.86 -38.94 79.89 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.05 -1.031 . . . . 0.0 110.462 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -130.4 -58.44 1.05 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.19 44.3 25.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.932 -1.105 . . . . 0.0 110.306 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -130.84 43.31 1.31 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.134 0 O-C-N 121.07 -1.253 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 CA-C-O 119.845 -0.121 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -79.28 102.96 1.56 Allowed 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.079 1.041 . . . . 0.0 110.347 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -137.73 158.11 45.06 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.072 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 78.2 t80 -115.65 162.06 17.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.112 -0.993 . . . . 0.0 110.089 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -136.18 132.83 36.47 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.202 -0.936 . . . . 0.0 110.187 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.1 t -112.44 94.1 4.76 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.085 -1.009 . . . . 0.0 110.051 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -52.06 -35.98 49.13 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.074 -1.016 . . . . 0.0 110.518 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.765 ' CD1' HG13 ' A' ' 34' ' ' VAL . 83.5 m-85 -61.07 -32.8 72.44 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.18 -0.95 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.5 m -97.47 -4.08 38.76 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.001 -1.062 . . . . 0.0 112.261 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 53.54 38.99 29.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.446 -1.409 . . . . 0.0 110.479 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -140.68 170.33 15.98 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.904 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.11 137.08 53.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -95.12 163.98 13.06 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.465 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.41 -31.65 11.2 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.041 -1.037 . . . . 0.0 111.724 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.5 m-70 -114.61 132.96 56.18 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.718 -1.239 . . . . 0.0 110.194 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.84 95.94 5.69 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.257 -0.902 . . . . 0.0 109.809 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -141.58 179.37 1.24 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.2 -0.937 . . . . 0.0 109.966 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.17 -28.04 19.25 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.314 1.165 . . . . 0.0 111.176 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.88 -41.94 10.89 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.901 -1.125 . . . . 0.0 109.974 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.436 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.1 t -60.92 -50.96 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.524 0 O-C-N 121.178 -0.951 . . . . 0.0 109.66 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -57.09 -51.11 70.61 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.125 -0.984 . . . . 0.0 109.607 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -61.33 -40.57 94.7 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.797 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 92.5 m -54.77 -43.56 72.87 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.121 -0.987 . . . . 0.0 108.443 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -63.47 -39.72 95.21 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.08 52.12 1.27 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -117.83 37.63 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.154 -0.966 . . . . 0.0 110.347 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.67 127.28 2.68 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.944 -1.263 . . . . 0.0 109.944 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -54.37 -28.69 44.87 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.033 -1.275 . . . . 0.0 110.169 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -58.46 -33.87 70.23 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 120.99 -1.068 . . . . 0.0 110.464 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -50.47 -38.71 45.35 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.925 -1.109 . . . . 0.0 110.75 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -63.16 -54.28 40.08 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.104 -0.998 . . . . 0.0 108.945 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -60.13 -38.98 84.69 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.11 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.11 -38.33 70.61 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.24 -0.913 . . . . 0.0 110.117 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.765 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.5 t -59.14 -37.32 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.062 -1.024 . . . . 0.0 109.879 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.3 ttpp -53.41 -39.97 64.73 Favored 'General case' 0 N--CA 1.513 2.724 0 O-C-N 120.887 -1.133 . . . . 0.0 109.845 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -58.47 -30.79 67.25 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.293 -0.879 . . . . 0.0 110.222 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -68.05 -53.26 27.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.984 -1.072 . . . . 0.0 109.967 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' OH ' ' HG3' ' A' ' 47' ' ' GLN . 41.7 p90 -100.08 33.29 2.66 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.097 -1.002 . . . . 0.0 111.248 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -73.62 -39.11 64.8 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.771 -1.205 . . . . 0.0 110.112 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -110.16 32.35 5.2 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.553 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' HE3' ' A' ' 42' ' ' MET . 21.7 t90 -107.27 -57.9 2.02 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.152 -0.968 . . . . 0.0 110.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.463 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 2.1 ttm -140.5 63.08 1.48 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.271 -0.893 . . . . 0.0 109.627 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -45.17 -34.15 2.59 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.363 -0.836 . . . . 0.0 111.587 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -81.35 129.41 34.61 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.042 -1.036 . . . . 0.0 109.32 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 54.71 71.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.976 -1.078 . . . . 0.0 110.213 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -131.25 -174.02 3.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.362 -0.836 . . . . 0.0 110.445 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.453 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 56.76 34.03 23.95 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.346 -0.846 . . . . 0.0 110.542 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.96 -56.57 2.31 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.11 -0.993 . . . . 0.0 109.368 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -22.2 62.12 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.223 -0.923 . . . . 0.0 111.213 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.743 HD12 HG11 ' A' ' 34' ' ' VAL . 42.5 mm -64.13 -42.78 96.66 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 120.702 -1.249 . . . . 0.0 108.991 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.73 -37.25 73.25 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.335 -0.853 . . . . 0.0 110.391 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -72.1 -34.55 68.73 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.617 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.4 m -83.73 -40.44 18.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.006 -1.059 . . . . 0.0 110.167 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.9 p -59.8 -37.57 79.51 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.121 -0.987 . . . . 0.0 110.176 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.02 -40.18 20.28 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.082 -1.011 . . . . 0.0 109.865 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.09 -34.77 66.32 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.164 -0.96 . . . . 0.0 110.492 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -91.95 11.89 23.56 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.085 -1.01 . . . . 0.0 111.989 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -114.16 -55.69 2.47 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.565 -1.334 . . . . 0.0 110.203 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -115.01 -56.32 2.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.198 -0.938 . . . . 0.0 110.163 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 125.75 -62.27 0.6 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.8 ttmt . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.214 -1.168 . . . . 0.0 110.184 -179.954 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ttt . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.87 171.11 18.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.41 1.216 . . . . 0.0 110.439 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 mttt 55.56 169.94 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.365 -0.834 . . . . 0.0 110.844 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.571 ' HD1' HD13 ' A' ' 13' ' ' LEU . 77.5 t80 -125.57 162.45 24.91 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.128 -0.982 . . . . 0.0 110.137 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -131.91 135.71 46.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.226 -0.921 . . . . 0.0 110.535 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -112.79 95.55 5.48 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.175 -0.953 . . . . 0.0 109.731 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.85 -35.24 31.51 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.16 -0.962 . . . . 0.0 110.725 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.858 ' CD1' HG13 ' A' ' 34' ' ' VAL . 74.3 m-85 -63.54 -30.64 71.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.094 -1.004 . . . . 0.0 110.155 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.6 m -100.01 -8.83 23.38 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.968 -1.082 . . . . 0.0 112.107 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 t0 55.91 40.64 30.5 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.368 -1.458 . . . . 0.0 110.121 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.04 173.64 11.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.313 -0.867 . . . . 0.0 109.957 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -120.64 131.13 54.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.685 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.571 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -88.42 172.04 9.67 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.239 -0.913 . . . . 0.0 109.567 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -98.3 -31.93 11.8 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.148 -0.97 . . . . 0.0 111.469 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 28.1 m-70 -121.04 134.65 55.29 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.807 -1.183 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.401 ' OD1' ' CD2' ' A' ' 4' ' ' PHE . 24.0 t0 -113.06 97.27 6.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.149 -0.97 . . . . 0.0 109.895 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -144.34 179.4 1.18 Allowed Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.225 -0.922 . . . . 0.0 110.015 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.19 -31.32 14.69 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.303 1.16 . . . . 0.0 110.853 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.8 t -86.16 -38.97 17.15 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.923 -1.11 . . . . 0.0 110.069 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 15' ' ' HIS . 80.7 t -67.61 -46.35 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.119 -0.988 . . . . 0.0 109.751 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.0 mtp180 -56.92 -52.34 65.57 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.054 -1.028 . . . . 0.0 109.757 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -60.67 -40.19 91.21 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.156 -0.965 . . . . 0.0 108.871 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.6 m -55.09 -43.37 73.89 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.101 -0.999 . . . . 0.0 108.515 178.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -62.29 -38.48 89.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.396 -0.815 . . . . 0.0 109.004 178.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -94.92 52.81 1.51 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.22 -0.925 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -117.66 39.47 3.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 109.899 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -132.78 160.11 23.71 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -88.32 -10.99 47.64 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.334 -1.098 . . . . 0.0 110.83 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtpp -91.14 -24.35 19.99 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.582 -1.324 . . . . 0.0 111.212 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.693 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.5 t-80 -48.9 -38.51 22.86 Favored 'General case' 0 N--CA 1.517 2.897 0 O-C-N 120.813 -1.179 . . . . 0.0 110.813 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -64.94 -54.41 31.04 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.24 -0.984 . . . . 0.0 108.906 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.03 -39.26 89.13 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.229 -0.92 . . . . 0.0 109.073 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -56.98 -37.18 71.27 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.13 -0.981 . . . . 0.0 110.021 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.858 HG13 ' CD1' ' A' ' 8' ' ' TYR . 71.8 t -55.85 -37.98 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 O-C-N 120.975 -1.078 . . . . 0.0 110.079 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.0 tttt -58.98 -42.96 91.21 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.057 -1.027 . . . . 0.0 109.293 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -59.35 -26.3 64.93 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.467 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -74.43 -51.92 13.54 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.875 -1.141 . . . . 0.0 110.426 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 34.4 p90 -99.41 31.98 2.93 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.057 -1.027 . . . . 0.0 111.495 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -76.16 -40.25 52.98 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.724 -1.235 . . . . 0.0 110.131 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mttp -84.65 -32.04 23.86 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.248 -0.908 . . . . 0.0 110.182 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 5.9 t90 -50.21 -45.31 53.63 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.971 -1.081 . . . . 0.0 111.058 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.468 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -114.72 -55.3 2.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 110.341 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 53.65 38.34 28.1 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.978 -1.076 . . . . 0.0 110.739 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -157.55 -56.66 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.183 -0.948 . . . . 0.0 110.761 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -164.18 82.77 0.42 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.165 -0.959 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.461 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -138.77 72.53 1.41 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.29 36.63 4.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.259 -0.901 . . . . 0.0 110.277 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.39 -53.85 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.148 -0.97 . . . . 0.0 109.745 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.37 -21.41 62.1 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.255 -0.903 . . . . 0.0 111.522 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.698 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -71.75 -50.68 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 O-C-N 120.608 -1.308 . . . . 0.0 109.521 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -64.86 -39.39 93.48 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.274 -0.891 . . . . 0.0 109.915 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -55.74 -33.43 64.26 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.095 -1.003 . . . . 0.0 110.731 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.1 m -90.13 -35.78 15.21 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 120.968 -1.083 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 69.1 p -79.96 -37.46 34.36 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.014 -1.054 . . . . 0.0 110.294 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.11 -39.87 40.0 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.065 -1.022 . . . . 0.0 109.812 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 52' ' ' LYS . . . -50.49 -31.11 14.43 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.087 -1.008 . . . . 0.0 111.18 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -82.67 -39.0 22.66 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.951 -1.093 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.02 77.95 1.66 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.065 -1.022 . . . . 0.0 110.577 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -163.61 42.16 0.1 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.154 -0.966 . . . . 0.0 110.882 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 137.28 -61.28 0.6 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.3 tttm . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.19 -1.183 . . . . 0.0 110.209 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mtt . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 92.18 0.8 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.417 1.22 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 61.4 mttt -133.79 146.07 50.35 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.221 -0.924 . . . . 0.0 110.175 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.592 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.2 t80 -108.04 161.45 14.94 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.28 -0.888 . . . . 0.0 110.164 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -135.05 137.45 42.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.283 -0.886 . . . . 0.0 110.002 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.7 t -119.26 96.91 5.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.101 -0.999 . . . . 0.0 110.294 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.87 -35.9 62.05 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.053 -1.029 . . . . 0.0 110.293 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.608 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.6 m-85 -60.59 -32.89 71.98 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.122 -0.986 . . . . 0.0 110.117 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.2 m -97.34 -4.37 38.69 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.061 -1.025 . . . . 0.0 112.198 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 53.45 39.4 29.9 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.376 -1.452 . . . . 0.0 110.573 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.76 170.06 16.4 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.294 -0.879 . . . . 0.0 109.992 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 14.6 t80 -118.41 134.05 55.38 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.322 -0.861 . . . . 0.0 110.423 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.592 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.7 mp -90.09 161.81 15.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.191 -0.943 . . . . 0.0 109.664 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.434 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.69 -21.95 16.16 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.101 -0.999 . . . . 0.0 111.888 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.776 ' HB2' HG11 ' A' ' 20' ' ' VAL . 42.7 m-70 -115.28 143.94 44.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.635 -1.291 . . . . 0.0 110.11 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -125.78 92.29 3.57 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 109.715 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.57 178.57 1.45 Allowed Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.229 -0.919 . . . . 0.0 110.043 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -70.82 -28.67 19.84 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.438 1.23 . . . . 0.0 111.078 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.61 -41.6 10.67 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.882 -1.136 . . . . 0.0 110.004 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.776 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.9 t -59.44 -54.05 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.093 -1.005 . . . . 0.0 109.728 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 20.4 mtp-105 -56.17 -50.52 70.95 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.163 -0.961 . . . . 0.0 109.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -61.99 -40.44 95.64 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.334 -0.946 . . . . 0.0 108.818 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.4 m -54.5 -43.07 71.49 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.117 -0.989 . . . . 0.0 108.368 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -62.45 -37.55 86.33 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.392 -0.818 . . . . 0.0 108.886 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -99.26 45.17 1.0 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.261 -0.899 . . . . 0.0 110.448 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -116.6 38.14 3.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.215 -0.928 . . . . 0.0 110.182 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.17 128.71 3.79 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.9 ttp85 -55.38 -27.49 47.87 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.225 -1.162 . . . . 0.0 110.545 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -62.53 -33.53 75.09 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.996 -1.065 . . . . 0.0 110.669 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.622 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.2 t-80 -51.32 -39.0 56.0 Favored 'General case' 0 N--CA 1.516 2.851 0 O-C-N 120.877 -1.139 . . . . 0.0 110.508 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -63.21 -55.1 27.81 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.35 -0.94 . . . . 0.0 109.057 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.01 -39.52 86.1 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.211 -0.93 . . . . 0.0 109.111 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -56.6 -38.27 71.79 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.17 -0.956 . . . . 0.0 110.012 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.675 HG11 HD12 ' A' ' 50' ' ' ILE . 71.5 t -56.73 -35.01 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.121 -0.987 . . . . 0.0 110.123 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 33.6 tttt -53.32 -44.57 68.5 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.812 -1.18 . . . . 0.0 109.932 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.42 -28.89 65.67 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.282 -0.887 . . . . 0.0 110.407 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -74.31 -50.75 17.53 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.947 -1.096 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.602 ' CE2' HG12 ' A' ' 34' ' ' VAL . 37.9 p90 -99.31 34.42 2.18 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.029 -1.044 . . . . 0.0 111.451 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -90.97 -41.21 11.25 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.723 -1.235 . . . . 0.0 109.656 178.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -112.53 32.83 5.33 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.346 -0.846 . . . . 0.0 110.26 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 16.2 t90 -97.7 -41.87 7.89 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.185 -0.947 . . . . 0.0 110.439 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.462 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -115.69 -67.96 0.96 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.063 -1.023 . . . . 0.0 110.108 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -167.17 -60.66 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.15 -0.969 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.21 -51.52 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.074 -1.016 . . . . 0.0 111.093 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -81.12 89.0 5.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.111 -0.993 . . . . 0.0 110.3 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.401 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -145.78 69.42 1.22 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.236 -0.915 . . . . 0.0 110.136 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -122.32 35.38 4.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.552 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -108.16 -52.68 2.73 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.194 -0.941 . . . . 0.0 109.499 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -20.94 63.34 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 111.478 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.675 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.77 -56.18 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 120.699 -1.251 . . . . 0.0 109.806 179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.421 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 70.0 m-20 -56.97 -39.43 74.59 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.167 -0.958 . . . . 0.0 110.312 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -57.13 -36.47 70.73 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.117 -0.99 . . . . 0.0 110.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.0 m -91.25 -35.92 14.21 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.063 -1.023 . . . . 0.0 110.541 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.421 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 80.6 p -77.37 -39.88 45.77 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.022 -1.049 . . . . 0.0 110.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.75 -40.6 92.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.101 -0.999 . . . . 0.0 109.898 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.56 79.94 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.221 -0.925 . . . . 0.0 110.221 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -53.14 -37.17 61.6 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 121.054 -1.029 . . . . 0.0 110.731 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -113.33 66.6 0.66 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.088 -1.008 . . . . 0.0 110.15 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -116.43 -57.03 2.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.115 -0.991 . . . . 0.0 110.249 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 63.61 75.15 0.37 Allowed Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.1 tttp . . . . . 0 N--CA 1.493 1.697 0 O-C-N 121.173 -1.193 . . . . 0.0 110.247 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.2 mtt . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.55 131.39 17.35 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.469 1.247 . . . . 0.0 110.387 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.441 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 16.8 mtmt -141.82 148.56 39.06 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.196 -0.94 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -110.88 152.07 27.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.221 -0.924 . . . . 0.0 109.629 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -128.95 136.0 49.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.2 t -110.15 94.5 5.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 110.168 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -51.73 -35.57 43.72 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.051 -1.03 . . . . 0.0 110.459 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.86 ' CD1' HG13 ' A' ' 34' ' ' VAL . 78.3 m-85 -61.85 -32.2 72.51 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.174 -0.953 . . . . 0.0 110.057 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.4 m -98.29 -0.96 42.92 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.993 -1.067 . . . . 0.0 112.146 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 52.25 38.87 25.87 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.407 -1.433 . . . . 0.0 110.69 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -140.21 171.23 14.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 109.978 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.441 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.4 OUTLIER -122.1 119.14 30.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.205 -0.935 . . . . 0.0 110.145 -179.758 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -75.99 166.71 23.09 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.145 -0.972 . . . . 0.0 109.489 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -100.37 -30.38 11.88 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.153 -0.967 . . . . 0.0 111.725 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.652 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.3 m-70 -112.44 142.18 45.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.732 -1.23 . . . . 0.0 110.154 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.41 89.71 3.18 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.184 -0.948 . . . . 0.0 109.714 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -136.59 178.44 1.74 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.847 . . . . 0.0 110.046 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.53 -29.94 19.46 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.8 m -90.32 -43.63 10.22 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.923 -1.11 . . . . 0.0 109.91 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.652 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.58 -53.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.632 0 O-C-N 121.184 -0.948 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 mtp-105 -56.76 -50.22 72.91 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.145 -0.972 . . . . 0.0 109.699 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -61.93 -40.29 94.98 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.316 -0.954 . . . . 0.0 108.802 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.7 m -54.53 -42.66 71.16 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.013 -1.054 . . . . 0.0 108.684 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -61.69 -37.63 84.83 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.167 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.32 53.12 1.47 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.234 -0.916 . . . . 0.0 110.423 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.71 38.22 3.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.1 -1.0 . . . . 0.0 110.101 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.25 130.01 4.45 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 -59.29 -23.98 62.88 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.231 -1.158 . . . . 0.0 110.854 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -71.06 -27.48 63.67 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 120.819 -1.176 . . . . 0.0 111.45 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.7 t-80 -49.55 -37.89 28.88 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.735 -1.228 . . . . 0.0 110.806 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -63.17 -54.2 41.38 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.087 -1.008 . . . . 0.0 109.112 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -60.46 -40.14 90.14 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.144 -0.972 . . . . 0.0 109.057 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -55.98 -37.22 68.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.223 -0.923 . . . . 0.0 110.046 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.86 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.8 t -55.92 -33.64 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.589 0 O-C-N 121.129 -0.982 . . . . 0.0 110.291 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 5.0 tttt -53.2 -41.94 65.79 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.825 -1.172 . . . . 0.0 109.994 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.56 -27.77 64.89 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.437 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.02 -52.26 13.3 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.877 -1.139 . . . . 0.0 110.499 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.905 ' CE2' ' HB3' ' A' ' 46' ' ' ALA . 35.5 p90 -99.01 31.63 2.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.004 -1.06 . . . . 0.0 111.656 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.59 -38.3 59.2 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.661 -1.274 . . . . 0.0 110.027 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.7 mttt -113.28 34.24 4.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.255 -0.903 . . . . 0.0 110.563 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -98.21 -47.12 5.58 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -148.14 -63.63 0.25 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.352 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -120.24 -177.29 3.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.305 -0.872 . . . . 0.0 110.251 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -97.72 -37.73 9.77 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.19 -0.943 . . . . 0.0 110.68 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -109.72 112.33 24.33 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.049 -1.032 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.905 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -148.74 76.74 1.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.217 -0.927 . . . . 0.0 110.242 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -106.48 35.71 2.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.063 -1.023 . . . . 0.0 110.462 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.9 -55.17 2.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.069 -1.019 . . . . 0.0 109.276 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.262 -0.899 . . . . 0.0 111.316 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -70.37 -44.78 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.7 -1.25 . . . . 0.0 109.514 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -58.13 -40.8 82.2 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.189 -0.944 . . . . 0.0 110.029 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 27.6 mttt -61.19 -34.91 75.84 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.234 -0.916 . . . . 0.0 110.483 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.44 HG22 ' HD2' ' A' ' 57' ' ' PHE . 86.1 m -87.59 -46.24 9.72 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.979 -1.076 . . . . 0.0 110.174 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.7 p -58.74 -37.63 76.62 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.072 -1.017 . . . . 0.0 110.251 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.86 -43.74 9.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.141 -0.974 . . . . 0.0 110.331 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.799 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -98.77 35.43 1.85 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.169 -0.957 . . . . 0.0 111.309 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.44 ' HD2' HG22 ' A' ' 53' ' ' THR . 14.7 t80 -58.83 -57.59 12.34 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.973 -1.079 . . . . 0.0 110.144 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -137.7 77.02 1.61 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.162 -0.961 . . . . 0.0 110.292 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -147.24 -59.18 0.27 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.38 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -119.77 -61.33 0.26 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.6 mttt . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.236 -1.156 . . . . 0.0 110.171 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.63 145.0 40.87 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.448 1.236 . . . . 0.0 110.477 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -148.21 140.97 24.62 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.148 -0.97 . . . . 0.0 110.352 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.612 ' HD1' HD13 ' A' ' 13' ' ' LEU . 71.7 t80 -111.86 162.66 15.05 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.269 -0.894 . . . . 0.0 110.01 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -137.75 137.1 37.94 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.033 -1.042 . . . . 0.0 110.853 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.2 t -114.23 100.74 8.58 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.177 -0.952 . . . . 0.0 109.91 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -58.09 -37.08 73.83 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.098 -1.002 . . . . 0.0 110.704 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -61.4 -34.96 76.23 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 120.996 -1.065 . . . . 0.0 110.046 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.6 m -90.03 -4.12 57.58 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.095 -1.003 . . . . 0.0 111.826 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.9 t70 53.74 39.4 30.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.393 -1.442 . . . . 0.0 110.473 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.18 171.89 13.44 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.279 -0.888 . . . . 0.0 109.995 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.4 120.81 37.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.243 -0.911 . . . . 0.0 110.086 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.612 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -74.7 166.91 22.81 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.13 -0.981 . . . . 0.0 109.559 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.497 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -101.12 -29.44 12.13 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.106 -0.996 . . . . 0.0 111.889 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.591 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.4 m-70 -114.62 148.11 38.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.782 -1.199 . . . . 0.0 110.342 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -124.59 97.52 5.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.203 -0.936 . . . . 0.0 109.764 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.29 178.08 1.56 Allowed Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.226 -0.921 . . . . 0.0 110.263 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -70.56 -30.67 18.24 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 O-C-N 123.405 1.213 . . . . 0.0 110.93 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.7 m -90.32 -39.78 12.52 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.978 -1.076 . . . . 0.0 109.989 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.591 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.5 t -60.2 -52.34 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.034 -1.041 . . . . 0.0 109.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -57.61 -49.39 76.56 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 121.13 -0.981 . . . . 0.0 109.583 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -41.4 99.09 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.728 178.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 78.8 m -54.59 -43.33 72.05 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.157 -0.964 . . . . 0.0 108.493 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.87 -37.16 85.76 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.648 -0.821 . . . . 0.0 109.062 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 50.32 1.04 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.206 -0.934 . . . . 0.0 110.331 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.22 38.11 3.32 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.057 -1.027 . . . . 0.0 110.382 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.34 126.41 2.39 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.836 -1.305 . . . . 0.0 109.836 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -53.75 -28.92 37.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.211 -1.17 . . . . 0.0 110.263 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -59.13 -32.74 70.12 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.05 -1.031 . . . . 0.0 110.605 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.499 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.54 -37.08 25.6 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.92 -1.112 . . . . 0.0 111.043 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -60.67 -53.62 55.27 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.071 -1.018 . . . . 0.0 109.157 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -39.03 85.52 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.181 -0.95 . . . . 0.0 109.03 178.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -56.03 -37.16 68.83 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.281 -0.887 . . . . 0.0 110.18 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.852 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.3 t -58.83 -37.2 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.06 -1.025 . . . . 0.0 109.796 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CZ ' ' A' ' 38' ' ' TYR . 9.0 tttp -54.76 -40.83 69.77 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.93 -1.106 . . . . 0.0 109.716 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.59 -32.4 70.35 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.95 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -65.51 -51.32 60.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.997 -1.064 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.656 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.8 p90 -99.87 34.21 2.35 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.06 -1.025 . . . . 0.0 111.323 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -39.21 15.87 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.813 -1.179 . . . . 0.0 109.733 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -114.27 34.55 4.63 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.237 -0.914 . . . . 0.0 110.358 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.459 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.6 t90 -88.5 -47.61 8.2 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.181 -0.949 . . . . 0.0 110.162 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.459 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -151.98 -64.18 0.17 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.182 -0.949 . . . . 0.0 110.639 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -129.24 -171.48 2.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.221 -0.924 . . . . 0.0 110.147 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -109.52 -179.74 3.91 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.22 -0.925 . . . . 0.0 110.14 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 53.27 74.56 0.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.121 -0.987 . . . . 0.0 110.687 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.443 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -135.23 73.5 1.48 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.271 -0.893 . . . . 0.0 110.166 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -112.18 35.19 3.86 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.203 -0.936 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.09 -54.21 2.56 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.054 -1.029 . . . . 0.0 109.325 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -21.24 63.1 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.268 -0.895 . . . . 0.0 111.334 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.628 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -74.05 -43.31 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.646 -1.284 . . . . 0.0 109.536 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 20.0 m-20 -64.53 -39.97 94.76 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.234 -0.916 . . . . 0.0 109.978 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -63.58 -33.64 76.05 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.229 -0.92 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.4 m -90.03 -39.15 13.12 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.066 -1.021 . . . . 0.0 110.39 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 5.5 p -57.84 -38.73 76.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.025 -1.047 . . . . 0.0 110.258 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.89 -48.51 81.4 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.167 -0.958 . . . . 0.0 109.954 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.4 76.38 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.221 -0.924 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -51.64 -37.02 48.44 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -131.68 76.69 1.72 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.123 -0.986 . . . . 0.0 110.152 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -109.59 -53.05 2.71 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.204 -0.935 . . . . 0.0 110.303 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 142.21 109.46 0.74 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 109.741 -1.344 . . . . 0.0 109.741 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.727 0 O-C-N 121.255 -1.144 . . . . 0.0 110.234 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.11 125.5 9.84 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.424 1.223 . . . . 0.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.9 mttt 56.26 168.08 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.297 -0.877 . . . . 0.0 110.733 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.58 ' HD2' HD13 ' A' ' 13' ' ' LEU . 79.9 t80 -124.89 162.21 24.9 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.11 -0.994 . . . . 0.0 109.912 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -139.7 132.43 29.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.231 -0.918 . . . . 0.0 110.434 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 t -112.84 89.88 3.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.204 -0.935 . . . . 0.0 109.973 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -51.31 -35.77 39.41 Favored 'General case' 0 N--CA 1.515 2.82 0 O-C-N 121.05 -1.031 . . . . 0.0 110.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.897 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.0 m-85 -59.92 -31.0 69.42 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.117 -0.99 . . . . 0.0 110.063 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.3 m -99.41 -0.15 41.48 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.929 -1.107 . . . . 0.0 112.239 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 52.84 38.41 26.63 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.326 -1.484 . . . . 0.0 110.656 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -142.16 170.46 15.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.224 -0.923 . . . . 0.0 110.022 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -121.45 142.92 49.56 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.212 -0.93 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.58 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -102.73 156.58 17.54 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.251 -0.906 . . . . 0.0 109.406 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.419 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -98.86 -30.83 12.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.13 -0.981 . . . . 0.0 111.594 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.456 ' O ' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -111.19 126.93 55.38 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.814 -1.179 . . . . 0.0 110.175 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -110.03 92.52 4.08 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.237 -0.915 . . . . 0.0 109.647 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.45 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -135.61 -179.72 1.15 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.43 -0.794 . . . . 0.0 109.765 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.72 -28.35 17.13 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.185 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.84 -43.55 9.97 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.881 -1.137 . . . . 0.0 110.07 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.456 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.5 t -59.14 -53.29 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.57 0 O-C-N 121.039 -1.038 . . . . 0.0 109.838 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.95 -50.14 73.54 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.074 -1.016 . . . . 0.0 109.625 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -61.91 -40.8 96.7 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.133 -0.98 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.6 m -54.56 -43.43 72.03 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.075 -1.016 . . . . 0.0 108.496 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -63.35 -40.91 98.57 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -93.25 56.61 2.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.342 -0.849 . . . . 0.0 110.197 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -119.11 37.09 4.23 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.131 -0.981 . . . . 0.0 110.401 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.29 123.37 1.74 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -51.12 -30.39 16.18 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.204 -1.174 . . . . 0.0 110.672 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -57.66 -33.79 68.7 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.013 -1.054 . . . . 0.0 110.596 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.49 -42.43 54.68 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.92 -1.113 . . . . 0.0 110.728 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -62.97 -53.31 56.07 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.107 -0.996 . . . . 0.0 109.055 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.68 88.89 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.232 -0.918 . . . . 0.0 109.04 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -55.66 -38.61 69.82 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.215 -0.928 . . . . 0.0 110.024 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.897 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.4 t -61.62 -38.76 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 121.176 -0.952 . . . . 0.0 109.662 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 12.8 mtmt -58.45 -45.24 88.96 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.053 -1.029 . . . . 0.0 109.395 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.92 -25.66 63.66 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.274 -0.891 . . . . 0.0 110.362 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -72.9 -50.78 21.62 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.84 -1.162 . . . . 0.0 110.583 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.516 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 37.6 p90 -99.85 34.88 2.15 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.994 -1.067 . . . . 0.0 111.464 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -38.96 14.22 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.769 -1.207 . . . . 0.0 109.871 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.42 32.02 6.07 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.268 -0.895 . . . . 0.0 110.663 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 17.4 t90 -85.39 -37.93 19.29 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.126 -0.984 . . . . 0.0 110.315 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.453 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.9 mtm -142.48 -67.36 0.38 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.103 -0.998 . . . . 0.0 110.206 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -156.98 38.82 0.31 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.095 -1.003 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 52.05 38.33 23.74 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.087 -1.008 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.37 74.8 1.55 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.104 -0.997 . . . . 0.0 110.2 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -154.83 73.44 0.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.199 -0.938 . . . . 0.0 110.687 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.45 35.15 4.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.947 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.4 t -109.86 -54.74 2.53 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.154 -0.966 . . . . 0.0 109.369 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.12 -20.01 64.97 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.282 -0.886 . . . . 0.0 111.365 179.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.812 HD12 HG11 ' A' ' 34' ' ' VAL . 50.0 mm -74.64 -41.09 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.698 -1.251 . . . . 0.0 109.914 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.423 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 3.5 t70 -67.29 -39.62 86.02 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.909 . . . . 0.0 110.146 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -56.3 -37.09 69.42 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.095 -1.003 . . . . 0.0 110.47 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.0 m -92.1 -36.29 13.42 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.227 -0.921 . . . . 0.0 110.567 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.627 HG23 ' O ' ' A' ' 50' ' ' ILE . 68.1 p -76.78 -42.72 39.68 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.55 94.41 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.215 -0.928 . . . . 0.0 110.0 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.93 30.21 3.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.115 -0.991 . . . . 0.0 111.595 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.92 -58.31 2.37 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.844 -1.16 . . . . 0.0 110.073 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -143.91 78.31 1.58 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.165 -0.96 . . . . 0.0 110.224 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -118.72 66.27 0.77 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.093 -1.004 . . . . 0.0 110.161 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.71 43.36 1.74 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.208 . . . . 0.0 110.171 -179.933 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.6 ttm . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.68 79.62 1.87 Allowed 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.411 1.216 . . . . 0.0 110.481 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 41.6 mttt -122.44 146.54 47.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.147 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.648 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.8 t80 -111.6 161.85 15.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.176 -0.953 . . . . 0.0 110.328 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -129.04 139.28 52.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.268 -0.895 . . . . 0.0 110.146 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -118.21 98.35 6.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.131 -0.981 . . . . 0.0 109.912 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.98 -36.05 48.47 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 121.033 -1.042 . . . . 0.0 110.75 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.817 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.2 m-85 -63.48 -30.92 71.96 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.036 -1.04 . . . . 0.0 110.254 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.0 m -99.46 -11.11 21.39 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.981 -1.075 . . . . 0.0 112.03 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t0 56.72 40.89 28.93 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.409 -1.432 . . . . 0.0 110.076 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -141.56 172.95 11.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.248 -0.907 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.5 t80 -119.92 128.41 53.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.304 -0.873 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.648 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.2 mp -82.27 169.75 16.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.2 -0.937 . . . . 0.0 109.732 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.445 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.0 t -97.43 -31.99 12.08 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.169 -0.957 . . . . 0.0 111.346 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.445 ' CG ' HG23 ' A' ' 14' ' ' THR . 30.4 m170 -116.04 137.6 51.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.91 -1.118 . . . . 0.0 110.126 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -114.19 96.44 5.8 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.209 -0.932 . . . . 0.0 109.838 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.36 177.96 1.61 Allowed Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.256 -0.902 . . . . 0.0 110.172 -179.707 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.02 -31.21 15.34 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.372 1.196 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.6 m -87.2 -39.76 15.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.912 -1.117 . . . . 0.0 110.084 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.433 HG11 ' O ' ' A' ' 15' ' ' HIS . 86.2 t -61.02 -47.81 91.9 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.226 -0.921 . . . . 0.0 109.716 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 20.5 mtt180 -57.53 -53.73 54.81 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.146 -0.972 . . . . 0.0 109.725 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -60.61 -40.08 90.54 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.191 -0.943 . . . . 0.0 109.009 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.1 m -56.22 -43.44 78.56 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.083 -1.011 . . . . 0.0 108.421 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.32 -36.87 81.34 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.028 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -97.48 49.38 1.04 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.146 -0.971 . . . . 0.0 110.389 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.82 37.76 3.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.12 -0.988 . . . . 0.0 110.284 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.61 129.51 4.02 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -54.42 -28.57 44.85 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.152 -1.205 . . . . 0.0 110.481 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -61.2 -35.16 76.43 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.996 -1.065 . . . . 0.0 110.503 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.491 ' O ' HG23 ' A' ' 34' ' ' VAL . 10.0 t-80 -51.68 -38.45 55.07 Favored 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.908 -1.12 . . . . 0.0 110.599 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -61.6 -55.74 27.41 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.114 -0.991 . . . . 0.0 109.245 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -58.97 -38.51 79.27 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.206 -0.934 . . . . 0.0 109.173 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.18 -38.33 70.79 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.163 -0.961 . . . . 0.0 110.128 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.854 ' CG1' HD12 ' A' ' 50' ' ' ILE . 98.2 t -63.52 -36.85 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.099 -1.001 . . . . 0.0 109.847 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -52.53 -40.58 62.62 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.007 -1.058 . . . . 0.0 109.821 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.71 -30.14 65.28 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.314 -0.866 . . . . 0.0 110.316 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.46 -53.48 19.03 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.885 -1.134 . . . . 0.0 109.946 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -100.11 34.39 2.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 111.198 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.77 -36.96 56.68 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 120.781 -1.199 . . . . 0.0 110.341 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.21 22.99 13.1 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.101 -0.999 . . . . 0.0 111.294 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.8 t90 -104.89 -49.46 3.49 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.865 -1.147 . . . . 0.0 110.238 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -103.54 -46.7 4.48 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.127 -0.983 . . . . 0.0 110.299 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 53.7 38.5 28.55 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.984 -1.073 . . . . 0.0 110.775 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -156.93 -65.82 0.1 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.634 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -164.69 77.68 0.33 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.18 -0.95 . . . . 0.0 110.788 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.54 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -122.84 73.7 1.16 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.166 -0.959 . . . . 0.0 110.431 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.1 35.9 4.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.284 -0.885 . . . . 0.0 110.388 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.0 m -111.21 -52.9 2.75 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.106 -0.996 . . . . 0.0 109.798 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.2 -21.3 61.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.134 -0.979 . . . . 0.0 111.551 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.854 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.4 mm -70.75 -38.61 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 120.719 -1.238 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -86.62 -39.97 15.6 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.106 -0.996 . . . . 0.0 110.065 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -64.27 -31.79 73.13 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.222 -0.924 . . . . 0.0 110.652 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.3 m -87.38 -44.94 10.99 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.964 -1.085 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 50' ' ' ILE . 16.9 p -56.04 -35.68 67.15 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 121.093 -1.004 . . . . 0.0 110.688 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.64 -39.75 15.79 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.062 -1.024 . . . . 0.0 109.919 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.99 85.36 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.111 -0.993 . . . . 0.0 110.162 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.67 -38.47 55.09 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.964 -1.085 . . . . 0.0 110.607 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -107.37 -50.98 2.98 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.147 -0.971 . . . . 0.0 110.391 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -113.2 66.4 0.65 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 110.259 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.02 -74.79 0.68 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tttt . . . . . 0 N--CA 1.495 1.777 0 O-C-N 121.254 -1.145 . . . . 0.0 110.211 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.55 142.51 36.55 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.382 1.201 . . . . 0.0 110.433 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.2 mttp 55.79 170.46 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.213 -0.929 . . . . 0.0 110.636 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -126.38 162.36 25.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.103 -0.998 . . . . 0.0 110.093 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -141.25 132.01 25.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -0.956 . . . . 0.0 110.393 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.4 t -110.63 88.87 2.88 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.203 -0.935 . . . . 0.0 109.553 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -50.96 -36.48 39.15 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.153 -0.967 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.975 ' CD2' HG13 ' A' ' 34' ' ' VAL . 26.6 m-85 -61.79 -30.55 70.89 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.041 -1.037 . . . . 0.0 110.127 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.0 m -98.15 -0.88 43.46 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.997 -1.064 . . . . 0.0 111.997 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 53.01 38.27 26.82 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.423 -1.423 . . . . 0.0 110.791 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.9 t -139.59 168.05 20.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.155 -0.966 . . . . 0.0 109.872 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -120.91 143.77 48.78 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.155 -0.966 . . . . 0.0 110.637 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.25 140.23 39.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -102.33 -21.03 14.38 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.074 -1.016 . . . . 0.0 112.441 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.555 ' CB ' HG21 ' A' ' 20' ' ' VAL . 40.0 m-70 -103.58 67.49 0.9 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.636 -1.29 . . . . 0.0 110.02 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.44 101.7 0.11 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.24 -0.912 . . . . 0.0 110.038 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.72 178.18 1.57 Allowed Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.026 -1.046 . . . . 0.0 110.251 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.88 -30.17 17.46 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.403 1.212 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 40.3 m -90.26 -40.77 11.96 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.888 -1.133 . . . . 0.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.555 HG21 ' CB ' ' A' ' 15' ' ' HIS . 98.1 t -59.6 -56.16 19.06 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.626 0 O-C-N 121.053 -1.029 . . . . 0.0 109.75 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.7 mtp85 -55.27 -50.28 69.92 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.072 -1.017 . . . . 0.0 109.899 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -62.34 -40.64 97.04 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.285 -0.966 . . . . 0.0 108.802 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 52.9 m -55.5 -43.08 75.32 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.097 -1.002 . . . . 0.0 108.368 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -64.73 -37.79 88.78 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.6 -0.84 . . . . 0.0 108.953 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -97.63 57.0 1.33 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.171 -0.956 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.13 37.73 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.129 -0.982 . . . . 0.0 110.443 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.13 122.69 1.25 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.84 -29.61 28.88 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.091 -1.241 . . . . 0.0 110.134 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -56.78 -31.99 65.21 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 33.9 t-80 -47.34 -38.64 13.29 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.132 -0.98 . . . . 0.0 111.306 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -55.06 26.74 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.006 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -59.49 -39.1 82.68 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.183 -0.948 . . . . 0.0 109.092 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -54.64 -36.38 64.47 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.194 -0.941 . . . . 0.0 110.261 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.975 HG13 ' CD2' ' A' ' 8' ' ' TYR . 89.1 t -55.34 -37.81 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.733 0 O-C-N 121.056 -1.027 . . . . 0.0 110.093 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 7.1 tttp -54.26 -39.67 67.07 Favored 'General case' 0 N--CA 1.514 2.737 0 O-C-N 121.073 -1.017 . . . . 0.0 109.894 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -59.8 -32.26 70.47 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.036 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 33.5 t80 -64.87 -52.17 58.06 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.954 -1.091 . . . . 0.0 110.169 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.535 ' HE2' HG12 ' A' ' 34' ' ' VAL . 49.3 p90 -100.38 34.69 2.31 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.097 -1.002 . . . . 0.0 111.15 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.6 14.56 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.736 -1.228 . . . . 0.0 109.788 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.36 34.47 4.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.247 -0.908 . . . . 0.0 110.415 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.486 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.7 t90 -93.5 -38.82 11.21 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.153 -0.967 . . . . 0.0 110.273 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.486 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.3 ttm -145.87 -62.19 0.33 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.177 -0.952 . . . . 0.0 110.392 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -143.35 -164.46 1.87 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.182 -0.949 . . . . 0.0 110.05 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.29 39.26 2.34 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.111 -0.993 . . . . 0.0 110.201 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -150.41 75.1 1.21 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.47 72.1 1.39 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.214 -0.928 . . . . 0.0 110.181 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.06 35.92 4.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.343 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -110.28 -54.94 2.52 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.147 -0.97 . . . . 0.0 109.309 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -21.06 64.12 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.204 -0.935 . . . . 0.0 111.208 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 34' ' ' VAL . 48.3 mm -74.36 -54.59 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.653 -1.28 . . . . 0.0 109.517 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 5.3 t0 -55.56 -39.67 70.94 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.14 -0.975 . . . . 0.0 110.3 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.81 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 14.7 tttt -59.74 -37.15 78.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.128 -0.983 . . . . 0.0 110.304 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 m -90.85 -40.52 11.71 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.064 -1.022 . . . . 0.0 110.076 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 66.8 p -68.27 -35.84 78.5 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.207 -0.933 . . . . 0.0 110.198 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 51' ' ' ASP . . . -90.79 -41.62 11.13 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.038 -1.038 . . . . 0.0 110.024 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.81 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -98.5 31.75 2.75 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.171 -0.956 . . . . 0.0 111.428 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.28 -58.35 8.65 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.961 -1.087 . . . . 0.0 109.863 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 52.25 39.07 26.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.096 -1.003 . . . . 0.0 110.954 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.27 39.3 26.85 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.001 -1.062 . . . . 0.0 110.782 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.28 -76.17 1.07 Allowed Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt . . . . . 0 N--CA 1.494 1.763 0 O-C-N 121.202 -1.175 . . . . 0.0 110.2 -179.977 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.4 ttm . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.91 110.45 3.04 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.29 1.153 . . . . 0.0 110.3 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 5.7 mttt -129.19 150.97 50.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.195 -0.94 . . . . 0.0 110.097 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.652 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.9 t80 -110.72 161.49 15.71 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.128 -0.983 . . . . 0.0 110.491 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 34.7 t80 -135.58 134.58 39.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.225 -0.922 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 39.3 t -114.27 96.67 5.91 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.125 -0.984 . . . . 0.0 110.1 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -53.52 -36.2 61.5 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.075 -1.016 . . . . 0.0 110.468 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.706 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -61.45 -32.76 72.75 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.138 -0.976 . . . . 0.0 110.074 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.9 m -96.51 -5.33 39.68 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.996 -1.065 . . . . 0.0 112.187 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 53.44 39.86 30.53 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.441 -1.412 . . . . 0.0 110.388 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -141.62 172.09 13.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.332 -0.855 . . . . 0.0 109.956 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.431 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 13.0 t80 -119.41 137.89 53.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.315 -0.866 . . . . 0.0 110.479 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.652 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.9 mp -96.59 168.29 10.62 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.237 -0.915 . . . . 0.0 109.587 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.412 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.2 t -98.88 -30.13 12.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.166 -0.958 . . . . 0.0 111.777 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.587 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.2 m170 -113.06 148.73 34.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.909 -1.119 . . . . 0.0 110.413 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -126.56 96.88 4.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.338 -0.851 . . . . 0.0 109.678 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -150.46 178.5 1.49 Allowed Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.258 -0.901 . . . . 0.0 110.283 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.6 Cg_endo -70.43 -32.01 16.55 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.37 1.195 . . . . 0.0 110.897 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.2 m -86.07 -40.34 15.83 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 120.929 -1.107 . . . . 0.0 109.878 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 15' ' ' HIS . 77.8 t -61.94 -50.2 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.194 -0.941 . . . . 0.0 109.496 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' CD ' ' CE2' ' A' ' 4' ' ' PHE . 36.2 mtm-85 -57.45 -50.24 73.67 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.49 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.49 -40.91 96.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.139 -0.976 . . . . 0.0 108.674 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.1 m -54.57 -43.69 72.29 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.122 -0.987 . . . . 0.0 108.463 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -62.77 -39.99 95.89 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -93.07 55.75 2.4 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.267 -0.896 . . . . 0.0 110.35 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.89 37.29 4.25 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.063 -1.023 . . . . 0.0 110.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.87 126.95 2.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -28.3 42.98 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.126 -1.22 . . . . 0.0 110.462 179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -60.94 -32.4 71.92 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.972 -1.08 . . . . 0.0 110.708 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.553 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.22 -39.95 45.98 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.946 -1.096 . . . . 0.0 110.75 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 -52.81 60.1 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.071 -1.018 . . . . 0.0 108.89 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -61.26 -39.73 91.45 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.481 -0.888 . . . . 0.0 108.918 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -56.29 -38.56 71.39 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.237 -0.915 . . . . 0.0 109.981 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.706 HG13 ' CD2' ' A' ' 8' ' ' TYR . 73.5 t -56.84 -35.47 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.646 0 O-C-N 121.091 -1.005 . . . . 0.0 110.027 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.0 tttt -53.07 -42.82 66.22 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.999 -1.063 . . . . 0.0 109.935 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -57.51 -31.35 65.94 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.196 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -64.31 -51.3 64.13 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.991 -1.068 . . . . 0.0 110.148 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -100.37 33.62 2.63 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.152 -0.967 . . . . 0.0 111.352 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -91.16 -38.52 12.68 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.801 -1.187 . . . . 0.0 110.054 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -111.28 29.11 8.1 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.221 -0.924 . . . . 0.0 110.894 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.503 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 25.9 t90 -92.56 -40.07 11.0 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.002 -1.061 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.503 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.0 tpp -145.8 -60.4 0.33 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.073 -1.017 . . . . 0.0 110.286 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.32 -164.63 2.02 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.199 -0.938 . . . . 0.0 110.242 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -109.89 39.39 2.14 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.198 -0.939 . . . . 0.0 110.134 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -152.0 75.89 1.16 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.158 -0.964 . . . . 0.0 110.36 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -138.94 74.29 1.47 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.237 -0.914 . . . . 0.0 110.272 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -111.89 35.86 3.54 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.191 -0.943 . . . . 0.0 110.341 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.4 p -110.48 -53.78 2.65 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.172 -0.955 . . . . 0.0 109.547 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.31 63.3 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.252 -0.905 . . . . 0.0 111.322 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.653 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -73.27 -54.5 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 120.61 -1.306 . . . . 0.0 109.552 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -57.29 -39.49 75.83 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.185 -0.947 . . . . 0.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 18.0 mtpt -63.85 -35.08 79.46 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.218 -0.926 . . . . 0.0 110.458 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.494 HG22 ' CD1' ' A' ' 57' ' ' PHE . 42.5 m -90.4 -46.93 8.05 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.028 -1.045 . . . . 0.0 110.235 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.5 p -55.45 -34.43 64.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.069 -1.019 . . . . 0.0 110.698 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -87.93 -36.99 16.8 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.046 -1.034 . . . . 0.0 110.33 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -98.12 37.18 1.46 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.001 -1.062 . . . . 0.0 111.131 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.494 ' CD1' HG22 ' A' ' 53' ' ' THR . 1.1 t80 -91.55 -39.17 12.06 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.95 -1.094 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -113.74 65.83 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.156 -0.965 . . . . 0.0 110.243 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -120.32 40.36 3.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.107 -0.995 . . . . 0.0 110.171 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -101.32 59.99 0.61 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.8 pttp . . . . . 0 N--CA 1.496 1.837 0 O-C-N 121.239 -1.154 . . . . 0.0 110.283 179.997 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.62 148.04 46.66 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.374 1.197 . . . . 0.0 110.529 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -143.92 158.95 43.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.472 ' HD1' HD13 ' A' ' 13' ' ' LEU . 62.6 t80 -115.08 154.68 28.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.192 -0.943 . . . . 0.0 109.868 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 11' ' ' THR . 66.2 t80 -130.93 141.03 50.25 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.007 -1.058 . . . . 0.0 110.563 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.2 t -119.15 92.61 3.84 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.289 -0.882 . . . . 0.0 109.793 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -53.09 -36.48 60.75 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.093 -1.005 . . . . 0.0 111.064 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.791 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -62.15 -32.58 73.2 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 120.997 -1.064 . . . . 0.0 109.957 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 45.9 m -94.73 -1.33 53.2 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.989 -1.069 . . . . 0.0 111.934 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.88 38.27 28.34 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.304 -1.498 . . . . 0.0 110.439 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.406 ' O ' ' CD1' ' A' ' 5' ' ' TYR . 8.3 t -143.38 171.53 14.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.164 -0.96 . . . . 0.0 110.011 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.7 OUTLIER -129.86 131.26 46.04 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 109.954 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.472 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.5 mp -87.99 161.67 17.27 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.117 -0.989 . . . . 0.0 110.145 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -97.22 -29.98 13.26 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.998 -1.064 . . . . 0.0 111.6 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.428 ' HB2' HG11 ' A' ' 20' ' ' VAL . 47.9 m-70 -106.88 130.77 54.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.903 -1.123 . . . . 0.0 109.974 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -114.18 76.89 1.01 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.165 -0.959 . . . . 0.0 110.002 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -119.87 -179.11 0.65 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.278 -0.889 . . . . 0.0 109.934 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.9 Cg_endo -72.83 -26.56 15.6 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.292 1.154 . . . . 0.0 111.507 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.1 t -92.06 -42.71 9.81 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.752 -1.218 . . . . 0.0 110.196 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 15' ' ' HIS . 81.4 t -57.82 -53.12 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.018 . . . . 0.0 109.932 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 mtp180 -55.98 -51.12 68.84 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.023 -1.048 . . . . 0.0 109.809 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -61.98 -40.8 96.85 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.143 -0.973 . . . . 0.0 108.728 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -54.64 -43.03 71.96 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.215 -0.928 . . . . 0.0 108.504 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -62.88 -37.8 88.34 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 119.627 -0.829 . . . . 0.0 108.979 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -97.26 51.39 1.1 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.224 -0.922 . . . . 0.0 110.2 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.32 37.99 3.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.355 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.4 127.76 2.84 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.52 -28.33 44.57 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.205 -1.173 . . . . 0.0 110.496 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -61.12 -33.15 72.92 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.88 -1.138 . . . . 0.0 110.669 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.6 t-80 -50.33 -41.34 51.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.933 -1.105 . . . . 0.0 110.87 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -61.79 -56.08 23.27 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.236 179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -59.0 -38.02 78.23 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.159 -0.963 . . . . 0.0 109.157 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -56.35 -39.35 72.73 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.113 -0.992 . . . . 0.0 110.041 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.791 HG13 ' CD1' ' A' ' 8' ' ' TYR . 84.2 t -62.86 -39.28 84.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 109.544 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -59.59 -42.45 92.6 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.058 -1.026 . . . . 0.0 109.215 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.42 -31.48 69.31 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.062 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -69.85 -51.73 30.97 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.922 -1.111 . . . . 0.0 110.249 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.718 ' HE2' HG12 ' A' ' 34' ' ' VAL . 42.3 p90 -99.88 33.89 2.44 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.073 -1.017 . . . . 0.0 111.34 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -39.73 17.46 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.78 -1.2 . . . . 0.0 109.874 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -90.34 -29.65 17.94 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.25 -0.906 . . . . 0.0 110.372 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.1 t90 -46.6 -33.89 4.53 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.086 -1.009 . . . . 0.0 111.788 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.454 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.5 mtt -151.77 -55.22 0.14 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.992 -1.068 . . . . 0.0 111.198 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 59.26 40.08 21.82 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.902 -1.124 . . . . 0.0 110.027 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -147.41 85.91 1.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.224 -0.922 . . . . 0.0 110.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 53.55 74.22 0.33 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.001 -1.062 . . . . 0.0 110.635 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -143.4 69.45 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.21 -0.931 . . . . 0.0 110.207 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -129.95 32.75 4.5 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 0.0 110.634 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.6 m -102.89 -48.21 4.14 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.055 -1.028 . . . . 0.0 109.605 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -21.64 61.84 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.184 -0.948 . . . . 0.0 111.42 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.785 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -83.47 -40.84 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.368 0 O-C-N 120.601 -1.312 . . . . 0.0 109.938 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -58.72 -40.35 83.47 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.168 -0.958 . . . . 0.0 110.09 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.31 -35.51 67.62 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.581 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.1 m -90.83 -35.93 14.51 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.047 -1.033 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.444 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 73.0 p -77.04 -40.27 46.99 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.986 -1.071 . . . . 0.0 110.04 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.01 89.59 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.177 -0.952 . . . . 0.0 109.955 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.59 -34.4 58.26 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.071 -1.018 . . . . 0.0 110.874 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -89.05 -35.93 16.07 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.993 -1.067 . . . . 0.0 110.42 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -76.23 -39.79 53.66 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.981 -1.074 . . . . 0.0 110.02 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -117.54 62.12 0.75 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.123 -0.986 . . . . 0.0 110.21 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.24 -109.01 3.35 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.3 ttpt . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.245 -1.15 . . . . 0.0 110.208 -179.996 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.85 77.61 2.27 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.493 1.26 . . . . 0.0 110.39 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -142.15 130.37 22.18 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.194 -0.941 . . . . 0.0 109.883 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 47.8 t80 -111.1 157.08 20.42 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.131 -0.981 . . . . 0.0 110.144 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -129.72 137.88 50.82 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.201 -0.937 . . . . 0.0 110.31 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.9 t -115.59 96.36 5.59 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.206 -0.934 . . . . 0.0 110.223 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -54.02 -36.35 62.9 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.057 -1.027 . . . . 0.0 110.341 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.778 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.7 m-85 -60.26 -33.97 73.07 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.071 -1.018 . . . . 0.0 110.039 179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' HG22 ' A' ' 11' ' ' THR . 38.0 m -94.73 0.88 55.36 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.118 -0.989 . . . . 0.0 112.036 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.49 37.56 19.76 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.468 -1.395 . . . . 0.0 110.797 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.413 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.1 t -146.26 171.26 15.22 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.24 -0.913 . . . . 0.0 110.173 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.17 124.55 47.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.043 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.413 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.5 mp -73.41 167.15 21.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.228 -0.92 . . . . 0.0 109.668 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.413 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.0 t -101.12 -28.46 12.68 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.139 -0.976 . . . . 0.0 111.951 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.691 ' HB2' HG11 ' A' ' 20' ' ' VAL . 40.6 m-70 -111.22 144.67 40.0 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.726 -1.234 . . . . 0.0 110.167 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -123.09 92.58 3.73 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 109.887 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -141.82 178.26 1.59 Allowed Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.243 -0.911 . . . . 0.0 110.047 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.43 -30.81 14.8 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.465 1.245 . . . . 0.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 t -89.96 -40.5 12.32 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.947 -1.096 . . . . 0.0 109.991 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.3 t -58.96 -53.17 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.125 -0.985 . . . . 0.0 109.787 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 32.9 mtm180 -56.81 -51.57 68.46 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.075 -1.016 . . . . 0.0 109.735 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -61.82 -40.17 94.34 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.286 -0.966 . . . . 0.0 108.968 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.4 -42.61 74.29 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.053 -1.029 . . . . 0.0 108.482 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.93 -36.35 83.14 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.348 -0.845 . . . . 0.0 109.172 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.69 46.37 0.97 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.172 -0.955 . . . . 0.0 110.448 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.58 38.51 3.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.108 -0.995 . . . . 0.0 110.199 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.34 126.49 2.6 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -28.27 45.41 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.185 -1.186 . . . . 0.0 110.287 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -58.35 -33.95 70.11 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.894 -1.128 . . . . 0.0 110.479 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.45 -37.65 39.41 Favored 'General case' 0 N--CA 1.516 2.834 0 O-C-N 120.963 -1.086 . . . . 0.0 110.733 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -55.56 28.58 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.027 -1.046 . . . . 0.0 109.126 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.19 -39.25 82.01 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.238 -0.914 . . . . 0.0 109.179 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.53 -37.43 70.45 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.218 -0.926 . . . . 0.0 110.072 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.778 HG13 ' CD2' ' A' ' 8' ' ' TYR . 87.2 t -57.9 -37.67 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.023 -1.048 . . . . 0.0 109.944 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 21.0 tttp -54.32 -40.43 67.95 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.947 -1.095 . . . . 0.0 109.669 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -58.37 -28.97 65.63 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.24 -0.913 . . . . 0.0 110.276 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -70.93 -54.32 11.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.882 -1.136 . . . . 0.0 109.996 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.6 p90 -99.01 27.77 4.82 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.159 -0.963 . . . . 0.0 111.536 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -62.92 -36.8 84.57 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.699 -1.251 . . . . 0.0 110.381 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -109.29 28.51 8.44 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.192 -0.942 . . . . 0.0 111.019 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.47 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 18.6 t90 -103.42 -49.77 3.62 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.089 -1.007 . . . . 0.0 110.041 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.47 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 1.3 ttm -148.94 -57.51 0.21 Allowed 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.203 -0.935 . . . . 0.0 110.413 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 55.03 -165.51 0.11 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.924 -1.11 . . . . 0.0 110.388 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 53.41 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.036 -1.04 . . . . 0.0 110.371 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 55.49 69.92 0.69 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.979 -1.076 . . . . 0.0 110.338 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.82 69.05 1.07 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.239 -0.913 . . . . 0.0 110.375 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -131.6 33.0 4.07 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.285 -0.884 . . . . 0.0 110.71 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.8 p -103.76 -49.9 3.54 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.097 -1.002 . . . . 0.0 109.389 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.15 -21.11 63.46 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.24 -0.912 . . . . 0.0 111.319 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.718 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -82.8 -40.15 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 120.723 -1.236 . . . . 0.0 109.951 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.466 ' HA ' ' HG1' ' A' ' 54' ' ' THR . 26.7 t0 -76.58 -40.7 48.8 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -57.07 -33.33 67.16 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.076 -1.015 . . . . 0.0 110.652 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 78.0 m -90.49 -43.04 10.5 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.968 -1.082 . . . . 0.0 110.34 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 50' ' ' ILE . 41.1 p -60.96 -40.23 92.57 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.084 -1.01 . . . . 0.0 110.004 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.25 92.49 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.209 -0.932 . . . . 0.0 109.976 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -51.75 -32.13 29.52 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.143 -0.973 . . . . 0.0 111.233 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -89.47 -35.08 16.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.989 -1.069 . . . . 0.0 110.705 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -100.87 -61.6 1.35 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.041 -1.037 . . . . 0.0 110.166 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 52.65 41.26 31.28 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.097 -1.002 . . . . 0.0 110.778 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 139.26 -60.33 0.58 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.115 -1.227 . . . . 0.0 110.13 179.986 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpp? . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.04 108.68 2.65 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 O-C-N 123.392 1.206 . . . . 0.0 110.624 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 9.3 mtmm -139.29 150.05 44.97 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.265 -0.897 . . . . 0.0 110.124 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.53 ' HD2' HD13 ' A' ' 13' ' ' LEU . 89.6 t80 -107.08 161.54 14.66 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.225 -0.922 . . . . 0.0 109.992 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -137.76 137.36 38.19 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.114 -0.991 . . . . 0.0 110.222 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 t -120.71 92.84 3.86 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.258 -0.901 . . . . 0.0 110.043 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -52.7 -36.16 56.85 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.041 -1.037 . . . . 0.0 110.424 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.906 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.6 m-85 -60.13 -33.81 72.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.087 -1.008 . . . . 0.0 110.01 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.8 m -94.21 -2.54 52.34 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.101 -0.999 . . . . 0.0 112.129 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.57 40.45 31.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.38 -1.45 . . . . 0.0 110.554 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.8 t -145.93 169.95 17.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.246 -0.909 . . . . 0.0 110.328 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.406 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 23.6 t80 -120.86 140.58 51.58 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.166 -0.959 . . . . 0.0 110.688 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.53 HD13 ' HD2' ' A' ' 4' ' ' PHE . 6.2 mp -97.04 164.42 12.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.9 t -101.48 -21.83 14.68 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.127 -0.983 . . . . 0.0 112.319 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.461 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.4 m170 -121.83 137.33 54.82 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.596 -1.315 . . . . 0.0 110.198 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -116.09 88.28 2.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.184 -0.947 . . . . 0.0 109.845 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -132.5 178.54 1.71 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.265 -0.897 . . . . 0.0 109.898 -179.617 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -70.88 -28.27 20.09 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.39 1.205 . . . . 0.0 111.285 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.5 m -91.99 -43.17 9.59 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.891 -1.131 . . . . 0.0 110.125 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.461 HG11 ' HB2' ' A' ' 15' ' ' HIS . 87.8 t -58.58 -53.34 48.19 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.091 -1.006 . . . . 0.0 109.905 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 4' ' ' PHE . 34.8 mtp180 -56.98 -50.0 74.01 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.034 -1.041 . . . . 0.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -40.53 96.62 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.122 -0.986 . . . . 0.0 108.692 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.7 m -54.0 -43.02 69.68 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.136 -0.977 . . . . 0.0 108.429 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.3 -38.65 91.98 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 119.565 -0.854 . . . . 0.0 108.822 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -98.57 47.36 0.99 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.206 -0.934 . . . . 0.0 110.466 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -115.37 40.13 2.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.14 -0.975 . . . . 0.0 109.887 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.68 147.86 19.43 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -76.88 -10.42 59.36 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.258 -1.142 . . . . 0.0 111.22 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -88.36 -26.09 22.39 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.652 -1.28 . . . . 0.0 111.079 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.421 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.2 t-80 -49.21 -40.16 32.5 Favored 'General case' 0 N--CA 1.518 2.949 0 O-C-N 120.814 -1.179 . . . . 0.0 110.903 -179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -62.72 -55.62 25.03 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.104 -0.998 . . . . 0.0 109.101 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.86 -38.65 82.73 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.208 -0.932 . . . . 0.0 109.124 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -56.62 -37.28 70.5 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.14 -0.975 . . . . 0.0 110.094 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.906 HG13 ' CD1' ' A' ' 8' ' ' TYR . 47.9 t -55.97 -36.52 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.029 -1.044 . . . . 0.0 109.993 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.4 ttpm? -55.38 -41.1 72.18 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 120.899 -1.125 . . . . 0.0 109.751 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -58.51 -26.05 63.06 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.308 -0.87 . . . . 0.0 110.552 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -73.64 -52.41 13.46 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.819 -1.176 . . . . 0.0 110.438 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.469 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 36.9 p90 -99.08 30.79 3.27 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.036 -1.04 . . . . 0.0 111.517 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -73.98 -41.45 61.9 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.668 -1.27 . . . . 0.0 109.692 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.09 22.85 11.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.314 -0.866 . . . . 0.0 111.117 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.458 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 24.9 t90 -56.41 -48.84 76.11 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.806 -1.184 . . . . 0.0 110.276 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.458 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -139.58 34.74 2.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.933 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 50.19 37.58 15.09 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.926 -1.109 . . . . 0.0 111.02 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -143.65 -172.84 3.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 110.279 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -109.12 114.25 27.81 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -113.92 76.59 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.286 -0.884 . . . . 0.0 110.216 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -108.85 36.37 2.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.168 -0.958 . . . . 0.0 110.371 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.29 -56.08 2.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.204 -0.935 . . . . 0.0 109.424 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.89 64.42 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.196 -0.94 . . . . 0.0 111.254 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.763 HD12 HG11 ' A' ' 34' ' ' VAL . 46.6 mm -69.35 -41.35 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.629 -1.294 . . . . 0.0 109.509 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.08 -39.05 56.21 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.281 -0.887 . . . . 0.0 110.007 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 0.9 OUTLIER -70.62 -34.54 72.22 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.158 -0.964 . . . . 0.0 110.529 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.5 m -80.75 -40.01 25.93 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.024 -1.048 . . . . 0.0 110.223 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 50' ' ' ILE . 19.6 p -62.83 -37.99 88.98 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.058 -1.026 . . . . 0.0 110.11 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.08 -43.76 9.21 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.119 -0.988 . . . . 0.0 110.183 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -93.9 57.54 2.47 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.139 -0.975 . . . . 0.0 110.186 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -92.5 -38.7 11.8 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.291 -0.881 . . . . 0.0 110.211 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -129.29 41.95 3.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.18 -0.95 . . . . 0.0 110.248 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.45 39.94 1.57 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.198 -0.939 . . . . 0.0 110.187 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -141.41 -98.42 0.33 Allowed Glycine 0 N--CA 1.494 2.552 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.0 mttt . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.197 -1.178 . . . . 0.0 110.217 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 tpt . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.53 154.72 55.25 Favored 'Trans proline' 0 C--N 1.318 -1.029 0 O-C-N 123.254 1.134 . . . . 0.0 110.453 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt 57.98 160.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.378 -0.826 . . . . 0.0 110.813 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.669 ' HD1' HD13 ' A' ' 13' ' ' LEU . 88.2 t80 -116.72 162.16 18.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.993 -1.067 . . . . 0.0 110.353 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -135.9 133.84 38.11 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -113.52 95.53 5.4 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.143 -0.973 . . . . 0.0 110.275 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -52.87 -35.94 58.42 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.065 -1.022 . . . . 0.0 110.34 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.548 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.2 m-85 -60.74 -31.99 71.29 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.136 -0.977 . . . . 0.0 110.11 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.9 m -98.59 -4.96 32.88 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.005 -1.059 . . . . 0.0 112.255 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 t0 54.14 39.59 30.85 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.46 -1.4 . . . . 0.0 110.337 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -142.16 172.96 11.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.195 -0.941 . . . . 0.0 110.032 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -120.03 135.44 54.93 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.262 -0.898 . . . . 0.0 110.594 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.669 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.2 mp -95.43 165.38 12.39 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.166 -0.959 . . . . 0.0 109.442 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.2 t -99.48 -22.16 15.62 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.063 -1.023 . . . . 0.0 112.031 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.775 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.5 m170 -117.17 145.95 43.51 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.721 -1.237 . . . . 0.0 110.282 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -127.81 92.85 3.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 109.569 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.455 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.81 178.93 1.28 Allowed Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.325 -0.86 . . . . 0.0 110.116 -179.529 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -70.53 -26.71 23.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.377 1.198 . . . . 0.0 111.108 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 m -92.66 -41.73 10.02 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.81 -1.181 . . . . 0.0 109.929 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.775 HG11 ' HB2' ' A' ' 15' ' ' HIS . 67.5 t -60.97 -52.49 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.128 -0.983 . . . . 0.0 109.602 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 -56.4 -50.37 71.82 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.053 -1.029 . . . . 0.0 109.558 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.25 -41.28 98.3 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.359 -0.936 . . . . 0.0 108.573 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 57.9 m -54.25 -43.68 71.12 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.081 -1.012 . . . . 0.0 108.445 178.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -62.22 -38.68 90.11 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.407 -0.808 . . . . 0.0 108.832 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -95.84 51.89 1.29 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.155 -0.966 . . . . 0.0 110.336 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.35 37.72 4.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.098 -1.001 . . . . 0.0 110.257 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.79 128.38 3.44 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 ttt-85 -53.83 -28.83 37.98 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.523 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -59.84 -36.35 76.67 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.925 -1.109 . . . . 0.0 110.349 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.599 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -52.16 -40.23 61.13 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.967 -1.083 . . . . 0.0 110.371 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -63.42 -55.05 27.42 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.181 -0.949 . . . . 0.0 109.069 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -60.25 -38.9 84.93 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.245 -0.909 . . . . 0.0 109.098 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -57.12 -38.84 74.02 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.156 -0.965 . . . . 0.0 109.849 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.924 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -60.15 -38.6 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.126 -0.984 . . . . 0.0 109.721 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -56.5 -49.24 75.3 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.988 -1.07 . . . . 0.0 109.445 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.72 -27.58 59.45 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.317 -0.865 . . . . 0.0 110.49 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -74.38 -50.59 17.98 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.904 -1.122 . . . . 0.0 110.548 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.658 ' CE2' HG12 ' A' ' 34' ' ' VAL . 38.5 p90 -99.53 34.43 2.22 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.016 -1.052 . . . . 0.0 111.552 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.4 tp60 -83.85 -40.47 18.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.726 -1.234 . . . . 0.0 109.824 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -115.02 29.43 8.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.264 -0.898 . . . . 0.0 110.83 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CE2' ' HE2' ' A' ' 42' ' ' MET . 12.3 t90 -51.27 -53.68 33.22 Favored 'General case' 0 N--CA 1.513 2.718 0 O-C-N 120.946 -1.096 . . . . 0.0 110.873 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CE2' ' A' ' 41' ' ' TRP . 19.6 mtm -144.7 -71.1 0.28 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.0 110.448 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -172.64 45.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.928 -1.107 . . . . 0.0 111.126 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -165.31 -168.19 1.32 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.124 -0.985 . . . . 0.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -115.47 126.63 54.55 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.208 -0.933 . . . . 0.0 110.074 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -116.34 74.74 0.92 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.03 35.81 3.11 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.047 -1.033 . . . . 0.0 110.395 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -112.09 -53.56 2.7 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.148 -0.97 . . . . 0.0 109.843 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -20.85 63.4 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.188 -0.945 . . . . 0.0 111.545 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.924 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -69.51 -47.61 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.677 -1.265 . . . . 0.0 109.58 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.5 -38.53 77.85 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.121 -0.987 . . . . 0.0 110.245 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -70.87 -35.31 72.32 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.13 -0.981 . . . . 0.0 110.417 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m -83.8 -39.73 19.63 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.004 -1.06 . . . . 0.0 110.174 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 p -59.39 -39.0 81.97 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.132 -0.98 . . . . 0.0 110.155 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.64 93.79 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.19 -0.944 . . . . 0.0 110.011 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.44 -38.11 65.92 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.058 -1.027 . . . . 0.0 110.605 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -55.55 -38.33 69.17 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.084 -1.01 . . . . 0.0 110.411 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 51.1 0.92 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.123 -0.985 . . . . 0.0 110.163 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 52.64 86.93 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.053 -1.029 . . . . 0.0 110.786 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.36 -49.11 1.6 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.0 tttm . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.22 -1.165 . . . . 0.0 110.188 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ttm . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.96 149.6 47.36 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.419 1.221 . . . . 0.0 110.517 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -138.56 151.87 47.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.189 -0.945 . . . . 0.0 110.015 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE2' ' NH2' ' A' ' 21' ' ' ARG . 37.2 t80 -115.85 156.2 26.53 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.189 -0.944 . . . . 0.0 109.912 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -140.52 140.5 35.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.156 -0.965 . . . . 0.0 110.442 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 t -113.17 98.54 7.2 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.251 -0.905 . . . . 0.0 109.99 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -56.47 -36.55 69.21 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.204 -0.935 . . . . 0.0 110.693 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 24.6 m-85 -62.5 -34.5 76.98 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.047 -1.033 . . . . 0.0 110.064 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.9 m -93.41 -3.18 53.67 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.055 -1.028 . . . . 0.0 112.004 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 53.98 38.73 29.48 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.4 -1.438 . . . . 0.0 110.457 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -134.66 171.68 14.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.265 -0.897 . . . . 0.0 109.86 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.09 120.54 32.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -83.0 162.05 21.56 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.12 -0.987 . . . . 0.0 109.493 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.44 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.4 t -101.09 -31.04 11.26 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.086 -1.009 . . . . 0.0 111.848 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.486 ' HB2' HG11 ' A' ' 20' ' ' VAL . 31.2 m170 -115.23 137.6 51.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.796 -1.19 . . . . 0.0 110.427 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -116.27 89.41 3.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.252 -0.905 . . . . 0.0 109.765 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -131.63 -179.99 1.2 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.857 . . . . 0.0 109.923 -179.568 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.33 -28.92 17.67 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.419 1.221 . . . . 0.0 111.093 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 t -92.27 -44.25 8.85 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.889 -1.132 . . . . 0.0 110.019 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.486 HG11 ' HB2' ' A' ' 15' ' ' HIS . 98.0 t -59.03 -52.23 63.16 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.052 -1.03 . . . . 0.0 109.825 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.449 ' NH2' ' CE2' ' A' ' 4' ' ' PHE . 24.9 mtp85 -58.49 -50.25 74.43 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.031 -1.043 . . . . 0.0 109.552 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -61.27 -39.9 92.12 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.186 -0.946 . . . . 0.0 108.881 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.5 m -54.03 -42.23 68.92 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.149 -0.969 . . . . 0.0 108.681 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.61 -39.58 94.74 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.2 t -93.9 57.3 2.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.304 -0.873 . . . . 0.0 110.084 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.5 m -113.06 37.87 3.01 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.104 -0.998 . . . . 0.0 110.557 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.28 126.55 1.99 Allowed Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.096 -1.201 . . . . 0.0 110.096 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -55.08 -28.19 50.54 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.058 -1.26 . . . . 0.0 110.165 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -57.8 -33.9 69.06 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.888 -1.133 . . . . 0.0 110.394 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.4 t-80 -49.45 -43.94 45.24 Favored 'General case' 0 N--CA 1.515 2.812 0 O-C-N 120.991 -1.068 . . . . 0.0 110.86 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.9 tttt -60.79 -54.08 49.55 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.061 -1.024 . . . . 0.0 109.185 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -60.03 -38.44 82.73 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.211 -0.931 . . . . 0.0 109.088 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -56.51 -37.17 70.06 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.173 -0.954 . . . . 0.0 110.198 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 84.0 t -61.91 -37.34 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 121.082 -1.011 . . . . 0.0 110.066 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.3 mtpt -54.24 -41.78 69.14 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.901 -1.124 . . . . 0.0 109.73 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.91 -28.89 66.62 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.291 178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -71.18 -52.16 20.75 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.924 -1.11 . . . . 0.0 110.285 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.52 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 37.9 p90 -100.09 35.8 1.99 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.079 -1.013 . . . . 0.0 111.263 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -37.9 14.28 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.85 -1.156 . . . . 0.0 110.151 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -112.87 27.82 9.31 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 111.165 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.426 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.0 t90 -70.18 -43.08 71.51 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.029 -1.045 . . . . 0.0 110.019 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.426 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -151.66 36.32 0.57 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.219 -0.926 . . . . 0.0 110.746 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 50.54 38.77 19.47 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.961 -1.087 . . . . 0.0 111.088 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -140.84 -173.94 3.85 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.139 -0.976 . . . . 0.0 110.304 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -112.77 116.69 30.48 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.52 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -115.77 73.47 0.84 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.201 -0.937 . . . . 0.0 110.221 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.74 36.76 2.32 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.082 -1.011 . . . . 0.0 110.205 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.8 p -113.08 -55.63 2.5 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.118 -0.989 . . . . 0.0 109.452 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -21.65 64.33 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.183 -0.948 . . . . 0.0 111.161 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HG11 ' A' ' 34' ' ' VAL . 44.3 mm -66.79 -41.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.618 -1.301 . . . . 0.0 109.219 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.458 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 1.4 t70 -61.17 -41.73 97.3 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.606 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -59.97 -36.49 77.22 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.189 -0.944 . . . . 0.0 110.14 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.45 ' CG2' ' CE1' ' A' ' 57' ' ' PHE . 46.5 m -84.71 -40.36 17.43 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.041 -1.037 . . . . 0.0 109.998 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.458 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 38.2 p -68.36 -39.6 81.77 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.108 -0.995 . . . . 0.0 109.789 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.66 -35.55 68.53 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 110.434 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.89 -36.19 15.19 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.995 -1.066 . . . . 0.0 110.336 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE1' ' CG2' ' A' ' 53' ' ' THR . 2.4 m-85 -49.93 -35.23 23.16 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.061 -1.024 . . . . 0.0 111.038 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -109.41 -52.77 2.73 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.118 -0.989 . . . . 0.0 110.376 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -115.33 67.51 0.7 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.12 -0.988 . . . . 0.0 110.242 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.76 66.78 0.26 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.2 mttm . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.203 -1.175 . . . . 0.0 110.237 -179.99 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.403 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.215 0 CA-C-O 119.81 -0.138 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 1' ' ' MET . 49.7 Cg_endo -79.08 168.39 20.6 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 123.097 1.051 . . . . 0.0 110.288 -179.746 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 mttm 61.69 125.84 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.176 -0.953 . . . . 0.0 110.531 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.495 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.0 t80 -103.83 161.18 14.17 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.948 -1.095 . . . . 0.0 110.192 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -133.39 137.27 45.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.167 -0.958 . . . . 0.0 110.435 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.6 t -113.69 98.96 7.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.303 -0.873 . . . . 0.0 110.077 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -56.48 -36.83 69.55 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.105 -0.997 . . . . 0.0 110.256 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.8 m-85 -59.7 -33.42 71.58 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.178 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.402 ' CB ' HG22 ' A' ' 11' ' ' THR . 39.1 m -95.56 0.15 52.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.016 -1.052 . . . . 0.0 112.112 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 51.92 37.78 21.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.398 -1.439 . . . . 0.0 110.741 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.402 HG22 ' CB ' ' A' ' 9' ' ' CYS . 8.3 t -144.24 171.75 13.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.233 -0.917 . . . . 0.0 109.892 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.38 125.27 47.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 110.206 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.3 mp -74.7 170.29 16.13 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.155 -0.966 . . . . 0.0 109.704 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.444 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.0 t -100.3 -31.8 11.17 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.217 -0.927 . . . . 0.0 111.681 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.494 ' HB2' HG11 ' A' ' 20' ' ' VAL . 30.0 m170 -116.54 142.21 47.17 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.83 -1.169 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -117.79 93.69 4.24 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 109.857 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.05 177.94 1.9 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 110.12 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.96 -31.11 15.69 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.426 1.224 . . . . 0.0 110.954 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -41.77 11.21 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.021 -1.049 . . . . 0.0 110.002 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.494 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.2 t -59.31 -54.29 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 109.911 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 14.8 mtp-105 -56.56 -49.87 73.58 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.102 -0.999 . . . . 0.0 109.907 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -40.47 97.65 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.163 -1.015 . . . . 0.0 108.794 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 55.8 m -54.74 -42.68 71.9 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.08 -1.013 . . . . 0.0 108.423 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -62.36 -35.76 80.12 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.256 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -100.62 42.8 1.09 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.096 -1.003 . . . . 0.0 110.479 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -115.34 38.42 3.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.203 -0.936 . . . . 0.0 110.213 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.75 128.37 3.45 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -54.11 -28.7 41.29 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.227 -1.161 . . . . 0.0 110.359 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -59.24 -35.38 73.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.973 -1.079 . . . . 0.0 110.397 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.558 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.6 t-80 -51.83 -39.04 58.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.91 -1.119 . . . . 0.0 110.473 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -62.19 -53.7 51.55 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.092 -1.005 . . . . 0.0 109.037 179.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -60.63 -39.22 87.42 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.037 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -56.26 -38.74 71.55 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.806 HG11 HD12 ' A' ' 50' ' ' ILE . 79.0 t -58.89 -38.95 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.55 0 O-C-N 121.042 -1.036 . . . . 0.0 109.597 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 1.2 tmmt? -54.47 -39.97 67.98 Favored 'General case' 0 N--CA 1.513 2.705 0 O-C-N 121.028 -1.045 . . . . 0.0 109.618 179.192 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.75 -33.14 69.94 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.37 -53.65 45.25 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.033 -1.042 . . . . 0.0 109.621 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.564 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.9 p90 -100.73 35.29 2.2 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.203 -0.936 . . . . 0.0 110.922 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.45 -35.91 53.48 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.753 -1.217 . . . . 0.0 110.293 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -102.27 21.21 15.39 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.063 -1.023 . . . . 0.0 111.402 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.466 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.2 t90 -106.93 -52.8 2.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.88 -1.138 . . . . 0.0 109.827 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.669 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 2.7 mtm -142.03 54.46 1.47 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.28 -0.888 . . . . 0.0 109.817 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -50.27 -34.99 25.25 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.121 -0.987 . . . . 0.0 111.272 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.2 -61.96 1.94 Allowed 'General case' 0 N--CA 1.513 2.705 0 O-C-N 120.937 -1.102 . . . . 0.0 110.585 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -147.75 96.62 2.7 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.423 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.669 ' HB2' ' HB3' ' A' ' 42' ' ' MET . . . -145.79 71.51 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.229 -0.919 . . . . 0.0 110.486 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 35.15 2.33 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.15 -0.969 . . . . 0.0 110.482 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.02 -52.88 2.71 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.061 -1.024 . . . . 0.0 109.578 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -20.93 64.1 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.262 -0.898 . . . . 0.0 111.334 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.806 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -75.13 -39.99 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 120.622 -1.299 . . . . 0.0 109.847 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.442 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 1.4 m-20 -75.76 -40.38 55.47 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.095 -1.003 . . . . 0.0 110.004 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.82 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 30.4 mtpt -57.42 -34.74 69.24 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.164 -0.96 . . . . 0.0 110.635 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.7 m -90.45 -38.66 13.11 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.021 -1.05 . . . . 0.0 110.247 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 50' ' ' ILE . 62.8 p -71.68 -34.79 69.99 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.077 -1.014 . . . . 0.0 110.401 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.93 -39.65 12.15 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.998 -1.064 . . . . 0.0 110.263 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.82 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.73 51.83 1.3 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.136 -0.978 . . . . 0.0 110.499 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -92.91 -59.49 2.04 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -149.05 51.63 0.97 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.198 -0.939 . . . . 0.0 110.484 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -119.4 -57.78 1.97 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.172 -0.955 . . . . 0.0 110.309 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -142.94 -61.07 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tttm . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.201 -1.176 . . . . 0.0 110.228 -179.95 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 mtm . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.71 115.93 4.53 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.442 1.233 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.454 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 42.8 mttt -127.55 152.31 47.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 90.2 t80 -109.65 161.98 14.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.167 -179.774 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -129.36 138.24 51.42 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.113 -0.992 . . . . 0.0 110.37 -179.873 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 47.4 t -117.11 96.77 5.59 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.17 -0.956 . . . . 0.0 109.967 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -51.88 -35.98 47.03 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.021 -1.05 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.708 ' CD1' HG13 ' A' ' 34' ' ' VAL . 76.9 m-85 -62.81 -31.19 72.13 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.186 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.449 ' HB3' HG22 ' A' ' 11' ' ' THR . 36.0 m -98.02 -9.45 26.02 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.008 -1.058 . . . . 0.0 111.965 179.786 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.1 t70 56.34 41.22 29.33 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.382 -1.449 . . . . 0.0 110.014 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.449 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.9 t -146.21 174.26 11.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.281 -0.887 . . . . 0.0 110.191 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.454 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.68 138.84 51.73 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.3 -0.875 . . . . 0.0 110.623 -179.686 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.4 mp -93.79 171.31 8.95 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.137 -0.977 . . . . 0.0 109.735 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -96.67 -30.2 13.38 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.26 -0.9 . . . . 0.0 111.368 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.719 ' HB2' HG11 ' A' ' 20' ' ' VAL . 49.6 m-70 -113.21 148.26 35.84 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.823 -1.173 . . . . 0.0 110.188 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -126.65 96.3 4.62 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.255 -0.903 . . . . 0.0 109.845 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -152.23 178.1 1.68 Allowed Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.234 -0.916 . . . . 0.0 110.456 -179.712 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.0 Cg_endo -70.72 -33.64 12.63 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.296 1.156 . . . . 0.0 110.74 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.7 m -84.65 -37.09 21.47 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.007 -1.058 . . . . 0.0 110.142 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.719 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.9 t -64.51 -45.81 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.084 -1.01 . . . . 0.0 109.438 179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -57.27 -50.77 71.84 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.992 -1.067 . . . . 0.0 109.571 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.65 -41.4 97.46 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.69 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.4 m -54.6 -43.43 72.15 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.18 -0.95 . . . . 0.0 108.612 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.435 ' ND1' HD21 ' A' ' 13' ' ' LEU . 75.4 t60 -61.13 -37.61 83.41 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.452 -0.78 . . . . 0.0 109.109 178.081 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.5 t -94.21 54.65 1.91 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.119 -0.988 . . . . 0.0 110.386 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.12 38.98 3.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.087 -1.008 . . . . 0.0 110.049 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.59 163.43 23.25 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -88.96 -12.49 41.42 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.323 -1.104 . . . . 0.0 110.901 178.909 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.1 mmtm -91.11 -26.64 19.03 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.634 -1.291 . . . . 0.0 111.177 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.549 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.3 t-80 -49.37 -38.66 29.3 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.836 -1.165 . . . . 0.0 110.751 -179.695 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -64.83 -53.44 46.77 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.216 -0.994 . . . . 0.0 108.981 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -61.09 -39.5 90.17 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.181 -0.949 . . . . 0.0 109.028 178.553 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -56.27 -37.98 70.56 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.137 -0.977 . . . . 0.0 110.055 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.708 HG13 ' CD1' ' A' ' 8' ' ' TYR . 64.4 t -59.74 -38.28 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 O-C-N 121.113 -0.992 . . . . 0.0 109.84 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -55.11 -40.69 70.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.912 -1.118 . . . . 0.0 109.782 179.54 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -58.36 -32.14 68.28 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.303 -0.873 . . . . 0.0 110.133 179.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -65.31 -52.84 51.44 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.965 -1.085 . . . . 0.0 110.116 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.599 ' HE2' HG12 ' A' ' 34' ' ' VAL . 47.9 p90 -100.55 35.5 2.12 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.082 -1.011 . . . . 0.0 111.061 179.611 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -81.63 -37.73 27.08 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.727 -1.233 . . . . 0.0 110.297 179.205 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -112.73 21.42 15.57 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.207 -0.933 . . . . 0.0 111.587 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 17.8 t90 -61.08 -46.49 90.45 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.809 -1.182 . . . . 0.0 109.858 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.6 mtm -152.65 36.24 0.5 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.211 -0.93 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.65 46.47 25.67 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.939 -1.101 . . . . 0.0 111.055 179.769 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -146.33 -172.3 3.92 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.107 -0.996 . . . . 0.0 110.374 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -110.86 162.95 14.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.155 -0.966 . . . . 0.0 109.999 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -168.75 77.57 0.12 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.167 -0.958 . . . . 0.0 111.164 -179.748 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -109.85 34.5 3.81 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.058 -1.026 . . . . 0.0 110.433 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.03 -57.71 2.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.182 -0.949 . . . . 0.0 109.101 179.251 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 pp -54.33 -26.34 29.1 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.195 -0.941 . . . . 0.0 111.271 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.638 HD12 HG11 ' A' ' 34' ' ' VAL . 41.5 mm -61.15 -41.51 89.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 120.646 -1.284 . . . . 0.0 109.483 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -36.29 79.53 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.229 -0.919 . . . . 0.0 110.753 -179.62 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.51 -39.61 11.84 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.059 -1.026 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -61.99 -39.75 93.27 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.154 -0.966 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 50' ' ' ILE . 30.8 p -57.18 -38.18 73.22 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.131 -0.98 . . . . 0.0 110.48 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.03 -40.08 11.28 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.141 -0.974 . . . . 0.0 110.153 179.81 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.84 54.56 1.75 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.116 -0.99 . . . . 0.0 110.337 179.736 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -93.05 -39.42 11.09 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.13 -0.981 . . . . 0.0 110.28 179.723 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -114.47 66.59 0.68 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.153 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -134.28 -59.2 0.83 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -131.76 64.82 0.6 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.2 mttm . . . . . 0 N--CA 1.502 2.159 0 O-C-N 121.125 -1.221 . . . . 0.0 110.778 -179.991 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mtp . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 112.44 3.52 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.44 1.232 . . . . 0.0 110.47 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.445 ' HE3' ' OG1' ' A' ' 14' ' ' THR . 23.8 mttp -146.61 154.2 41.22 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.24 -0.913 . . . . 0.0 110.413 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.445 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 43.1 t80 -110.21 156.04 21.19 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.202 -0.936 . . . . 0.0 109.886 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -138.38 136.8 36.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.608 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 t -110.6 93.45 4.5 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.2 -0.938 . . . . 0.0 110.089 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -52.23 -36.23 51.82 Favored 'General case' 0 N--CA 1.513 2.703 0 O-C-N 121.072 -1.017 . . . . 0.0 110.515 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.863 ' CD1' HG13 ' A' ' 34' ' ' VAL . 87.5 m-85 -60.34 -32.58 71.39 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.133 -0.98 . . . . 0.0 110.025 178.979 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.1 m -97.45 -0.52 46.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.057 -1.027 . . . . 0.0 112.162 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 t70 52.73 38.93 27.62 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.383 -1.448 . . . . 0.0 110.599 -179.709 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -137.56 172.76 12.49 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.286 -0.884 . . . . 0.0 110.021 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.0 120.17 32.57 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.31 -0.869 . . . . 0.0 110.131 -179.759 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -82.17 146.34 29.61 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.193 -0.942 . . . . 0.0 109.612 179.472 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.445 ' OG1' ' HE3' ' A' ' 3' ' ' LYS . 14.1 t -104.06 -20.55 13.81 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.073 -1.017 . . . . 0.0 112.62 -179.35 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.532 ' HB2' HG11 ' A' ' 20' ' ' VAL . 27.7 m-70 -106.16 70.44 0.84 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.587 -1.32 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -61.11 101.78 0.17 Allowed 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.197 -0.939 . . . . 0.0 109.874 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.22 176.63 2.12 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.022 -1.049 . . . . 0.0 110.314 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.83 -31.86 15.07 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.519 1.273 . . . . 0.0 110.89 179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -91.1 -39.78 11.97 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.953 -1.092 . . . . 0.0 110.222 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.0 t -60.01 -49.18 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.568 0 O-C-N 121.155 -0.966 . . . . 0.0 109.663 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.445 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 16.5 mtp180 -58.56 -51.73 68.64 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.079 -1.013 . . . . 0.0 109.609 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -40.6 97.6 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.262 -0.975 . . . . 0.0 108.818 179.014 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 93.8 m -56.0 -42.88 77.08 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.077 -1.014 . . . . 0.0 108.37 178.316 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -63.53 -36.38 83.59 Favored 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.152 178.13 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 t -100.16 43.85 1.04 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.138 -0.976 . . . . 0.0 110.473 -179.671 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.77 38.49 3.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.182 -0.949 . . . . 0.0 110.138 179.773 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.95 127.32 2.97 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -54.63 -28.33 46.07 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.087 -1.243 . . . . 0.0 110.226 178.955 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -58.92 -33.63 70.79 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.991 -1.068 . . . . 0.0 110.681 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.606 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.84 -38.44 49.01 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.876 -1.14 . . . . 0.0 110.705 -179.41 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -63.65 -53.03 57.83 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.135 -0.978 . . . . 0.0 108.942 179.289 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.98 -39.89 91.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.239 -0.913 . . . . 0.0 108.944 178.642 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -56.11 -38.12 70.34 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.211 -0.931 . . . . 0.0 110.083 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.863 HG13 ' CD1' ' A' ' 8' ' ' TYR . 79.3 t -57.58 -36.8 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.069 -1.019 . . . . 0.0 110.032 179.626 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.9 tttt -53.02 -40.96 64.24 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.924 -1.11 . . . . 0.0 109.892 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -58.79 -29.67 67.0 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.223 178.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -68.55 -52.4 32.28 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.976 -1.078 . . . . 0.0 110.257 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 43.4 p90 -100.09 33.58 2.58 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.004 -1.06 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.46 -64.71 1.11 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.791 -1.193 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' CG ' ' A' ' 43' ' ' GLU . 1.3 tptm -64.42 -34.64 78.65 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.304 -0.873 . . . . 0.0 110.086 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 8.5 t90 -52.52 -48.07 66.28 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.041 -1.037 . . . . 0.0 111.278 -179.453 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -105.82 -45.22 4.44 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.02 -1.05 . . . . 0.0 111.26 -179.308 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.406 ' CG ' ' HA ' ' A' ' 40' ' ' LYS . 40.1 mm-40 53.4 37.63 25.97 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.974 -1.079 . . . . 0.0 110.704 -179.504 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -160.75 -66.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.222 -0.924 . . . . 0.0 110.83 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -158.54 104.87 1.82 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.264 -0.897 . . . . 0.0 110.809 -179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -145.79 70.67 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.24 -0.912 . . . . 0.0 110.326 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -120.46 36.76 4.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.373 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.7 -53.71 2.67 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.195 -0.941 . . . . 0.0 109.654 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.35 -21.05 63.66 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.196 -0.94 . . . . 0.0 111.464 179.537 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 48.5 mm -72.61 -40.1 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 120.626 -1.296 . . . . 0.0 109.777 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 7.1 m-20 -65.67 -40.15 92.11 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.124 -0.985 . . . . 0.0 109.971 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 14.2 mttt -64.18 -35.2 80.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.136 -0.977 . . . . 0.0 110.502 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.7 m -87.64 -40.42 14.2 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.008 -1.057 . . . . 0.0 110.131 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 50' ' ' ILE . 18.8 p -59.11 -36.41 75.12 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.158 -0.964 . . . . 0.0 110.289 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.81 -43.93 9.74 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.062 -1.023 . . . . 0.0 110.003 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -93.75 58.64 2.7 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 179.561 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -92.59 11.61 25.95 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.241 -0.912 . . . . 0.0 112.098 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 54.63 93.45 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.433 -1.417 . . . . 0.0 110.433 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -87.72 -39.57 14.85 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.335 -0.853 . . . . 0.0 110.115 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.82 -110.35 3.47 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.894 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt . . . . . 0 N--CA 1.499 2.013 0 O-C-N 121.164 -1.198 . . . . 0.0 110.766 -179.979 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.7 mtt . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.52 101.55 1.28 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.39 1.205 . . . . 0.0 110.349 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.7 mtmm -120.28 146.35 46.18 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.177 -0.952 . . . . 0.0 110.276 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' HD13 ' A' ' 13' ' ' LEU . 42.3 t80 -114.75 156.43 24.84 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.965 . . . . 0.0 109.921 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -136.08 135.94 39.77 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.104 -0.997 . . . . 0.0 110.561 -179.733 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 t -111.63 93.82 4.66 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.224 -0.922 . . . . 0.0 110.202 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -52.64 -35.85 55.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.115 -0.991 . . . . 0.0 110.379 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.851 ' CD1' HG13 ' A' ' 34' ' ' VAL . 79.7 m-85 -60.86 -32.85 72.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.176 -0.952 . . . . 0.0 110.098 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.3 m -96.95 -0.71 47.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.991 -1.068 . . . . 0.0 112.084 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t70 53.07 38.64 27.88 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.367 -1.458 . . . . 0.0 110.656 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -139.43 171.68 13.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.147 -0.971 . . . . 0.0 110.036 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.17 120.39 34.08 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.184 -0.947 . . . . 0.0 110.032 -179.66 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.519 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.6 mp -78.25 166.14 23.06 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.161 -0.962 . . . . 0.0 109.558 179.43 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.414 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.0 t -102.22 -30.43 11.11 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.085 -1.009 . . . . 0.0 112.013 -179.367 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.414 ' CG ' HG23 ' A' ' 14' ' ' THR . 32.1 m170 -113.72 139.78 48.8 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.682 -1.261 . . . . 0.0 110.5 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -116.13 94.98 4.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.359 -0.838 . . . . 0.0 109.765 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.24 176.53 2.25 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.234 -0.916 . . . . 0.0 110.169 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.49 -30.33 23.71 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 O-C-N 123.386 1.203 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.5 t -88.01 -41.47 13.09 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.931 -1.105 . . . . 0.0 109.974 179.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.3 t -59.82 -50.47 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.187 -0.946 . . . . 0.0 109.787 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' NH1' ' CE1' ' A' ' 4' ' ' PHE . 19.4 mtt180 -58.06 -51.73 68.46 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.053 -1.029 . . . . 0.0 109.611 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -60.85 -40.58 93.43 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.958 178.848 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.0 m -55.36 -43.04 74.7 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 121.145 -0.972 . . . . 0.0 108.507 178.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -64.37 -39.71 94.4 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.425 -0.797 . . . . 0.0 108.95 178.148 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.17 56.53 2.54 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.145 -0.972 . . . . 0.0 110.274 -179.775 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 37.86 3.57 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.049 -1.032 . . . . 0.0 110.403 179.815 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.49 125.2 2.01 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -54.71 -27.96 44.5 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.174 -1.192 . . . . 0.0 110.359 179.051 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 tptt -60.62 -31.78 70.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.933 -1.104 . . . . 0.0 110.764 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.597 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.2 t-80 -49.83 -42.59 47.61 Favored 'General case' 0 N--CA 1.517 2.892 0 O-C-N 120.884 -1.135 . . . . 0.0 110.865 -179.492 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -62.7 -52.56 62.81 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.116 -0.99 . . . . 0.0 109.109 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -61.4 -40.23 93.62 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.194 -0.941 . . . . 0.0 108.894 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -56.27 -37.94 70.5 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.324 -0.86 . . . . 0.0 109.914 179.083 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.851 HG13 ' CD1' ' A' ' 8' ' ' TYR . 78.2 t -55.95 -34.52 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.602 0 O-C-N 121.05 -1.031 . . . . 0.0 110.141 179.632 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.462 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -54.82 -42.92 72.47 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.858 -1.151 . . . . 0.0 109.763 179.421 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.39 -27.97 64.76 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 178.904 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.03 -52.08 26.98 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.891 -1.131 . . . . 0.0 110.325 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.466 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 40.6 p90 -99.69 32.53 2.82 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.991 -1.068 . . . . 0.0 111.404 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -82.49 -38.46 23.85 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.728 -1.233 . . . . 0.0 109.805 178.68 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.5 tttp -109.28 31.35 5.81 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.234 -0.916 . . . . 0.0 110.548 179.261 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 7.8 t90 -85.84 -40.49 15.92 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.062 -1.024 . . . . 0.0 110.134 -179.904 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.544 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 14.8 ptp -176.59 -43.69 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.139 -0.976 . . . . 0.0 112.038 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -116.62 176.8 4.95 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.677 -1.264 . . . . 0.0 110.452 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -101.12 -42.72 6.26 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.277 -0.89 . . . . 0.0 110.594 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -105.04 83.49 1.99 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.039 -1.038 . . . . 0.0 110.198 179.896 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.466 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -117.13 75.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.204 -0.935 . . . . 0.0 110.107 -179.99 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.44 35.63 3.11 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 110.461 179.598 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -110.29 -54.31 2.59 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.126 -0.984 . . . . 0.0 109.401 179.222 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -20.96 64.21 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.203 -0.936 . . . . 0.0 111.297 179.18 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.418 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.6 mm -71.81 -46.32 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.646 -1.284 . . . . 0.0 109.446 179.615 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.431 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 14.9 t70 -60.56 -38.47 84.65 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.236 -0.915 . . . . 0.0 110.028 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.848 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -55.38 -35.06 64.89 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.045 -1.034 . . . . 0.0 110.659 -179.855 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m -91.47 -38.7 12.39 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.041 -1.037 . . . . 0.0 110.303 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 82.7 p -74.64 -34.52 62.77 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.071 -1.018 . . . . 0.0 110.461 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.99 -38.17 13.82 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.972 -1.08 . . . . 0.0 110.178 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.848 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.15 46.14 1.04 Allowed 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.002 -1.061 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.63 -59.05 2.16 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.153 -0.967 . . . . 0.0 110.134 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -146.8 71.47 1.23 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.192 -0.943 . . . . 0.0 110.486 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -145.43 82.31 1.64 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.087 -1.008 . . . . 0.0 110.338 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -87.11 -99.7 0.84 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.451 -1.459 . . . . 0.0 109.451 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.0 tptm . . . . . 0 N--CA 1.493 1.705 0 O-C-N 121.158 -1.201 . . . . 0.0 110.203 179.987 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.79 140.85 32.8 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.449 1.236 . . . . 0.0 110.408 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 25.4 mttt -129.55 154.25 47.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.227 -0.921 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.624 ' HD1' HD13 ' A' ' 13' ' ' LEU . 69.8 t80 -112.78 162.01 16.25 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -131.08 136.74 48.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.466 -179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.3 t -116.16 98.37 6.58 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.264 -0.898 . . . . 0.0 109.826 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -51.82 -35.92 46.05 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.015 -1.053 . . . . 0.0 110.782 -179.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.567 ' CD2' HG13 ' A' ' 34' ' ' VAL . 78.9 m-85 -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.088 -1.008 . . . . 0.0 110.291 179.4 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.0 m -97.29 -10.49 25.6 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.097 -1.002 . . . . 0.0 111.881 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 55.91 40.78 30.48 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.462 -1.399 . . . . 0.0 110.172 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -142.11 170.72 15.19 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.22 -0.925 . . . . 0.0 109.984 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.7 t80 -117.17 125.21 50.84 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.265 -0.897 . . . . 0.0 110.398 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.624 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.3 mp -80.61 170.68 16.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.203 -0.936 . . . . 0.0 109.72 179.67 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.424 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.1 t -96.91 -30.49 13.09 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.204 -0.935 . . . . 0.0 111.334 -179.793 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 32.6 m170 -113.69 146.44 39.82 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.875 -1.141 . . . . 0.0 110.205 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -125.95 93.52 3.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.123 -0.985 . . . . 0.0 109.727 179.81 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -146.73 179.75 1.11 Allowed Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.511 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -71.75 -32.12 12.1 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.341 1.18 . . . . 0.0 110.935 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -39.21 17.03 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.949 -1.094 . . . . 0.0 109.95 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 61.3 t -64.61 -47.48 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.12 -0.987 . . . . 0.0 109.609 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -57.62 -52.58 64.82 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.038 -1.039 . . . . 0.0 109.714 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -60.03 -39.84 87.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.128 -0.982 . . . . 0.0 108.943 178.882 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.3 m -55.08 -43.78 74.26 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.051 -1.031 . . . . 0.0 108.4 178.267 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.407 ' ND1' HD21 ' A' ' 13' ' ' LEU . 71.2 t60 -62.25 -37.46 85.53 Favored 'General case' 0 N--CA 1.504 2.252 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.84 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.34 48.46 0.99 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.216 -0.927 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.05 38.27 3.23 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.087 -1.008 . . . . 0.0 110.245 179.805 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.89 127.66 2.86 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -54.21 -28.52 41.52 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.106 -1.232 . . . . 0.0 110.32 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -58.68 -35.5 72.7 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.058 -1.026 . . . . 0.0 110.462 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.577 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.0 t-80 -51.74 -40.7 60.7 Favored 'General case' 0 N--CA 1.515 2.788 0 O-C-N 121.03 -1.044 . . . . 0.0 110.427 -179.709 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -63.06 -52.22 63.61 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.123 -0.986 . . . . 0.0 108.819 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.65 -39.92 93.06 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.185 -0.947 . . . . 0.0 108.868 178.507 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -56.21 -38.58 71.22 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.961 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.666 HG12 ' HE2' ' A' ' 38' ' ' TYR . 70.6 t -58.56 -38.89 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.125 -0.984 . . . . 0.0 109.712 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.6 mtmp? -57.29 -44.83 84.37 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.059 -1.025 . . . . 0.0 109.261 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.7 -31.81 64.85 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.339 -0.851 . . . . 0.0 110.051 178.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -64.07 -53.16 54.19 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.98 -1.075 . . . . 0.0 109.769 179.729 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.666 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -99.69 28.03 4.98 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.111 -0.993 . . . . 0.0 111.602 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -56.45 -41.0 75.74 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.637 -1.29 . . . . 0.0 110.064 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -126.94 28.42 5.81 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.248 -0.908 . . . . 0.0 111.199 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.1 t90 -52.59 -36.28 55.82 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.903 -1.123 . . . . 0.0 110.805 -179.72 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.464 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -138.35 -67.71 0.46 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.143 -0.973 . . . . 0.0 110.398 179.908 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -170.93 -52.01 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.092 -1.005 . . . . 0.0 111.138 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.08 -168.83 2.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.224 -0.922 . . . . 0.0 109.771 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -95.62 144.51 26.0 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.088 -1.008 . . . . 0.0 110.25 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HB1' HD21 ' A' ' 49' ' ' LEU . . . -123.64 84.52 2.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.224 -0.923 . . . . 0.0 110.333 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -105.49 34.39 3.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 110.598 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.8 p -112.5 -55.04 2.56 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.112 -0.993 . . . . 0.0 109.314 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.478 HD21 ' HB1' ' A' ' 46' ' ' ALA . 0.6 OUTLIER -60.06 -21.62 61.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.3 -0.875 . . . . 0.0 111.403 179.225 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG11 ' A' ' 34' ' ' VAL . 46.4 mm -68.93 -48.38 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.58 -1.325 . . . . 0.0 109.395 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.457 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -58.99 -39.18 80.99 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.165 -0.96 . . . . 0.0 110.191 -179.912 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -56.48 -36.61 69.31 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.211 -0.931 . . . . 0.0 110.72 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.8 m -91.69 -46.92 7.65 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.096 -1.002 . . . . 0.0 110.406 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.457 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 48.1 p -57.84 -36.45 72.31 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.143 -0.973 . . . . 0.0 110.595 -179.785 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.13 -41.07 23.02 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.063 -1.023 . . . . 0.0 109.928 179.756 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.13 48.96 1.05 Allowed 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.212 -0.93 . . . . 0.0 110.485 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -92.73 -58.79 2.24 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.14 -0.975 . . . . 0.0 110.323 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -120.64 -58.26 1.84 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.176 -0.952 . . . . 0.0 110.399 -179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -116.99 67.85 0.74 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.82 -41.26 19.51 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 ttmt . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.157 179.961 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.0 147.99 44.35 Favored 'Trans proline' 0 C--N 1.316 -1.137 0 O-C-N 123.396 1.209 . . . . 0.0 110.448 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -141.28 156.69 45.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.279 -0.888 . . . . 0.0 110.047 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.3 t80 -110.85 161.5 15.74 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.14 -0.975 . . . . 0.0 110.188 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -137.4 133.26 34.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.914 . . . . 0.0 110.194 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.1 t -113.91 94.64 4.92 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.118 -0.989 . . . . 0.0 110.173 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -52.85 -35.9 58.12 Favored 'General case' 0 N--CA 1.513 2.689 0 O-C-N 121.025 -1.047 . . . . 0.0 110.478 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.0 m-85 -60.59 -32.91 71.99 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.159 -0.963 . . . . 0.0 110.106 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.9 m -96.63 -3.89 42.0 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.063 -1.023 . . . . 0.0 112.181 -179.908 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 t70 53.69 39.12 29.8 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.383 -1.448 . . . . 0.0 110.458 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -141.98 170.72 15.18 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.217 -0.927 . . . . 0.0 109.914 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -119.49 136.74 54.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.779 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.2 mp -96.26 161.88 13.76 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.267 -0.895 . . . . 0.0 109.578 179.322 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.46 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.9 t -98.57 -21.81 16.29 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.076 -1.015 . . . . 0.0 111.81 -179.691 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 51.6 m-70 -114.37 143.99 44.0 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.709 -1.245 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -125.67 92.54 3.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 109.715 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -147.43 177.9 1.62 Allowed Pre-proline 0 N--CA 1.496 1.868 0 O-C-N 121.279 -0.888 . . . . 0.0 110.214 -179.518 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.51 -33.26 14.04 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.395 1.208 . . . . 0.0 110.775 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.5 m -84.2 -39.2 19.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.956 -1.09 . . . . 0.0 110.035 179.569 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 70.1 t -64.38 -45.93 94.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.061 -1.024 . . . . 0.0 109.451 179.75 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 -59.71 -52.28 66.17 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.175 -0.953 . . . . 0.0 109.351 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -59.55 -39.67 84.74 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.137 -0.977 . . . . 0.0 108.908 178.865 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -55.39 -43.68 75.41 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.143 -0.973 . . . . 0.0 108.406 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.49 -40.4 96.99 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 t -92.5 56.95 2.84 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.285 -0.884 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.36 37.9 3.4 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.086 -1.009 . . . . 0.0 110.378 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.43 123.68 1.6 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -29.65 29.7 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.104 -1.233 . . . . 0.0 110.192 178.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 6.2 ptpt -57.12 -32.87 66.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.724 179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.613 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.4 t-80 -49.82 -41.76 45.54 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.978 -1.076 . . . . 0.0 110.737 -179.612 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -62.68 -54.45 39.11 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.16 -0.962 . . . . 0.0 108.986 179.167 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.43 -39.67 88.27 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.108 178.713 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -56.76 -37.6 71.27 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.227 -0.921 . . . . 0.0 110.018 179.118 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.948 HG11 HD12 ' A' ' 50' ' ' ILE . 73.5 t -56.67 -35.95 47.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.041 -1.037 . . . . 0.0 110.268 179.71 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.7 ttmm -57.35 -44.89 84.69 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.86 -1.15 . . . . 0.0 109.677 179.357 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.29 -25.13 63.86 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.479 178.966 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.41 -50.44 15.86 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.832 -1.167 . . . . 0.0 110.676 -179.723 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 34.5 p90 -99.49 32.96 2.61 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.976 -1.077 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -83.97 -38.43 20.99 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.715 -1.24 . . . . 0.0 109.927 178.795 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -112.01 32.21 5.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.117 -0.989 . . . . 0.0 110.583 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.6 t90 -90.82 -39.2 12.49 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.152 -0.968 . . . . 0.0 110.094 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -150.58 -63.26 0.2 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.224 -0.923 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -140.47 -171.67 3.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.56 39.3 2.13 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.173 -0.955 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -147.37 74.71 1.34 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.229 -0.92 . . . . 0.0 110.241 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -142.74 72.49 1.37 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.248 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 36.36 3.89 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.284 -0.885 . . . . 0.0 110.322 179.643 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -111.04 -54.9 2.56 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -20.17 65.29 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.24 -0.912 . . . . 0.0 111.285 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.948 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -72.79 -52.95 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 O-C-N 120.719 -1.238 . . . . 0.0 109.705 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.63 -40.25 86.99 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.197 -0.939 . . . . 0.0 110.075 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 tptp -56.21 -32.23 64.21 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.075 -1.015 . . . . 0.0 110.802 -179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 m -85.2 -34.5 22.02 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.961 -1.087 . . . . 0.0 110.816 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 81.0 p -85.37 -41.98 14.96 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.969 -1.082 . . . . 0.0 110.001 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.81 71.66 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.192 -0.943 . . . . 0.0 110.485 179.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.99 -32.49 16.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.013 -1.054 . . . . 0.0 110.878 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.42 -37.87 27.07 Favored 'General case' 0 N--CA 1.519 2.983 0 O-C-N 120.955 -1.09 . . . . 0.0 110.843 -179.615 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -118.33 -68.23 0.93 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.143 -0.973 . . . . 0.0 110.306 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -170.6 -60.64 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.14 -0.975 . . . . 0.0 110.865 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -148.35 -76.43 0.02 OUTLIER Glycine 0 N--CA 1.495 2.618 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.995 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.283 -1.128 . . . . 0.0 110.226 179.966 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.5 mtt . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.99 124.42 9.6 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 O-C-N 123.397 1.209 . . . . 0.0 110.499 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -119.4 163.29 17.44 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.239 -0.913 . . . . 0.0 109.992 179.904 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -115.48 162.12 17.63 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.186 -0.946 . . . . 0.0 110.101 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -140.12 132.51 28.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.157 -0.965 . . . . 0.0 110.284 -179.621 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.4 t -113.66 90.09 3.25 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.21 -0.932 . . . . 0.0 109.967 179.403 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -51.65 -35.75 43.37 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.029 -1.044 . . . . 0.0 110.348 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 87.1 m-85 -59.56 -31.65 69.63 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.978 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.8 m -98.24 0.02 44.92 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.016 -1.053 . . . . 0.0 112.258 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t0 52.63 38.9 27.2 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.381 -1.45 . . . . 0.0 110.666 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -143.21 172.15 13.12 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.32 -0.862 . . . . 0.0 110.029 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -123.6 139.73 53.71 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.287 -0.883 . . . . 0.0 110.871 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -100.44 163.09 12.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.264 -0.897 . . . . 0.0 109.36 179.314 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.503 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.72 -30.91 11.46 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.064 -1.022 . . . . 0.0 111.849 -179.247 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' A' ' 14' ' ' THR . 47.9 m-70 -113.02 134.89 54.31 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.792 -1.193 . . . . 0.0 110.3 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -115.39 82.43 1.75 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.178 -0.951 . . . . 0.0 109.776 179.731 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -126.32 -179.93 1.03 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.288 -0.882 . . . . 0.0 110.008 -179.658 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.24 -29.37 17.32 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.364 1.192 . . . . 0.0 111.099 179.979 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 t -88.84 -46.31 9.04 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.867 -1.145 . . . . 0.0 110.033 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.46 HG11 ' HB2' ' A' ' 15' ' ' HIS . 91.2 t -58.55 -55.09 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.133 -0.98 . . . . 0.0 109.98 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -55.55 -50.83 68.99 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.067 -1.021 . . . . 0.0 109.85 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.5 mttm -61.88 -39.85 93.34 Favored 'General case' 0 N--CA 1.506 2.36 0 C-N-CA 119.298 -0.961 . . . . 0.0 108.867 178.781 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 74.0 m -54.88 -42.95 72.71 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.11 -0.994 . . . . 0.0 108.433 178.267 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -62.25 -39.51 93.1 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.887 178.119 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.423 ' CB ' ' CE1' ' A' ' 57' ' ' PHE . 5.4 t -94.7 53.22 1.6 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.287 -0.883 . . . . 0.0 110.417 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.34 39.83 3.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.088 -1.008 . . . . 0.0 109.992 179.648 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.13 154.07 21.44 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -83.83 -10.26 58.17 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.327 -1.102 . . . . 0.0 111.074 178.827 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttm -90.51 -24.36 20.67 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.696 -1.253 . . . . 0.0 111.115 179.471 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.0 t-80 -48.63 -38.75 21.86 Favored 'General case' 0 N--CA 1.517 2.911 0 O-C-N 120.767 -1.208 . . . . 0.0 110.853 -179.716 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -65.53 -53.78 37.36 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.275 -0.97 . . . . 0.0 108.83 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.29 -39.33 90.05 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.17 -0.956 . . . . 0.0 108.981 178.615 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -56.66 -37.16 70.43 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.21 -0.931 . . . . 0.0 110.167 179.193 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 58.0 t -58.62 -43.4 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.024 -1.047 . . . . 0.0 109.726 179.837 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 24.1 ttmt -62.32 -43.25 99.25 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.986 179.086 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -60.61 -24.43 65.49 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.295 178.625 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -75.81 -51.83 11.73 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.764 -1.21 . . . . 0.0 110.452 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.516 ' HE2' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -98.94 28.99 4.02 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.002 -1.061 . . . . 0.0 111.643 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.08 -41.41 97.32 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.66 -1.275 . . . . 0.0 109.664 179.299 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -117.49 25.91 10.09 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.362 -0.836 . . . . 0.0 111.162 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.484 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.2 t90 -56.87 -39.25 73.98 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.963 -1.085 . . . . 0.0 110.344 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.484 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.2 ttm -147.03 33.55 0.91 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 49.79 37.59 13.64 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.955 -1.091 . . . . 0.0 111.258 179.692 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -145.01 -171.64 3.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.157 -0.964 . . . . 0.0 110.408 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -111.02 128.42 55.85 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.186 -0.946 . . . . 0.0 110.057 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.4 75.82 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.286 -0.884 . . . . 0.0 110.314 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.99 35.64 3.17 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.195 -0.94 . . . . 0.0 110.319 179.411 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.9 t -111.26 -55.58 2.48 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.151 -0.968 . . . . 0.0 109.294 179.277 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -20.84 65.53 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.229 -0.92 . . . . 0.0 111.118 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.796 HD12 HG11 ' A' ' 34' ' ' VAL . 47.0 mm -71.91 -49.09 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.668 -1.27 . . . . 0.0 109.546 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.406 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -68.4 -41.37 80.57 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.123 -0.986 . . . . 0.0 109.939 179.881 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.4 mmtm -59.95 -34.98 73.98 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.159 -0.963 . . . . 0.0 110.478 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.8 m -91.38 -40.15 11.61 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.996 -1.065 . . . . 0.0 110.518 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.578 HG23 ' O ' ' A' ' 50' ' ' ILE . 47.1 p -65.32 -39.37 92.35 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.069 -1.019 . . . . 0.0 110.068 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.49 -38.38 71.66 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.101 -1.0 . . . . 0.0 110.366 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.55 48.65 1.09 Allowed 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.198 -0.938 . . . . 0.0 110.716 179.643 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.423 ' CE1' ' CB ' ' A' ' 25' ' ' CYS . 7.2 t80 -92.89 -37.37 12.3 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.151 -0.968 . . . . 0.0 110.373 179.681 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -111.86 65.84 0.63 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.125 -0.984 . . . . 0.0 110.181 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.89 46.73 1.6 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.247 -0.908 . . . . 0.0 110.107 179.861 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.34 -41.16 26.58 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.909 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mttp . . . . . 0 N--CA 1.496 1.831 0 O-C-N 121.132 -1.217 . . . . 0.0 110.19 179.969 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 ptp . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.64 146.48 43.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.396 1.208 . . . . 0.0 110.41 -179.911 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -132.8 153.12 51.56 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.637 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.0 t80 -112.16 162.55 15.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.161 -0.962 . . . . 0.0 110.466 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -132.22 139.65 48.39 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.15 -0.969 . . . . 0.0 110.223 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -121.06 96.86 5.26 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.08 -1.013 . . . . 0.0 110.098 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -53.53 -36.4 61.74 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.061 -1.024 . . . . 0.0 110.407 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.807 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.8 m-85 -60.7 -32.02 71.27 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.095 -1.003 . . . . 0.0 110.125 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.9 m -96.82 -6.07 36.88 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.966 -1.084 . . . . 0.0 112.126 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 54.17 39.45 30.73 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.453 -1.405 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.4 t -144.71 169.92 17.08 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.267 -0.895 . . . . 0.0 110.021 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -115.84 130.94 57.04 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.205 -0.934 . . . . 0.0 110.425 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.637 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.5 mp -84.88 169.3 14.25 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.183 -0.948 . . . . 0.0 109.756 179.615 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.432 HG23 ' ND1' ' A' ' 15' ' ' HIS . 13.7 t -100.81 -21.83 15.03 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.195 -0.941 . . . . 0.0 112.108 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.564 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.1 m170 -126.26 143.44 51.15 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.616 -1.303 . . . . 0.0 110.315 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -120.79 92.04 3.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -139.06 178.21 1.74 Allowed Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.227 -0.921 . . . . 0.0 109.985 -179.55 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.66 -29.43 19.58 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.394 1.207 . . . . 0.0 111.114 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -90.96 -41.61 11.03 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.899 -1.126 . . . . 0.0 110.033 179.612 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.564 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.7 t -60.11 -49.82 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.807 179.823 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -57.96 -51.67 68.68 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.066 -1.021 . . . . 0.0 109.661 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -61.81 -40.37 95.03 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.16 -0.962 . . . . 0.0 108.799 178.851 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -55.16 -43.1 73.95 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.142 -0.974 . . . . 0.0 108.382 178.237 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -63.07 -38.97 93.31 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.927 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.66 50.97 1.14 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.22 -0.925 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.7 m -117.79 37.73 3.85 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.096 -1.002 . . . . 0.0 110.313 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.77 126.95 2.77 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.2 ttt85 -54.4 -28.44 43.61 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.235 -1.156 . . . . 0.0 110.319 179.078 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -59.2 -34.76 72.54 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.96 -1.088 . . . . 0.0 110.35 179.861 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.704 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.1 t-80 -51.14 -40.19 58.0 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.912 -1.117 . . . . 0.0 110.514 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -63.33 -54.68 33.24 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.263 -0.975 . . . . 0.0 109.025 179.182 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.69 -39.52 88.81 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 178.68 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -57.01 -37.76 72.14 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.199 -0.938 . . . . 0.0 110.035 179.18 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.807 HG13 ' CD1' ' A' ' 8' ' ' TYR . 85.8 t -56.5 -34.04 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 O-C-N 121.093 -1.004 . . . . 0.0 110.253 179.75 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.8 tttp -52.85 -40.95 63.82 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.855 -1.153 . . . . 0.0 110.029 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -59.33 -29.6 67.76 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.261 178.868 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -68.05 -51.55 45.4 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.94 -1.1 . . . . 0.0 110.327 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.681 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 45.0 p90 -100.16 35.62 2.04 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.068 -1.02 . . . . 0.0 111.157 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -87.95 -37.91 16.01 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.863 -1.148 . . . . 0.0 110.001 178.694 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -110.79 29.63 7.57 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.273 -0.892 . . . . 0.0 110.865 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.428 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 26.5 t90 -93.98 -42.74 8.89 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.02 -1.05 . . . . 0.0 110.01 179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.428 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -145.59 -60.28 0.34 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.206 -0.934 . . . . 0.0 110.382 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -146.08 -171.17 3.66 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.128 -0.983 . . . . 0.0 110.266 -179.919 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -106.59 39.57 1.81 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.122 -0.986 . . . . 0.0 110.137 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -150.75 76.14 1.24 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.259 -0.9 . . . . 0.0 110.405 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.681 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -141.15 73.66 1.43 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.17 -0.956 . . . . 0.0 110.297 -179.902 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.22 35.49 4.63 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.597 179.673 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 5.5 p -110.58 -54.18 2.61 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.068 -1.02 . . . . 0.0 109.463 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -61.47 -20.9 63.66 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.183 -0.948 . . . . 0.0 111.377 179.28 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.55 HD12 HG11 ' A' ' 34' ' ' VAL . 47.3 mm -71.56 -42.64 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 120.719 -1.238 . . . . 0.0 109.509 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.46 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 23.7 t70 -65.22 -39.57 92.95 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.161 -0.962 . . . . 0.0 110.053 -179.998 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -64.36 -34.83 79.07 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.08 -1.013 . . . . 0.0 110.626 -179.873 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m -90.73 -39.09 12.62 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 120.993 -1.067 . . . . 0.0 110.447 179.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 50' ' ' ILE . 17.6 p -57.13 -38.17 73.09 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.0 -1.063 . . . . 0.0 110.372 -179.931 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.65 -40.4 83.34 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.09 -1.006 . . . . 0.0 110.145 179.983 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.07 93.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.188 -0.945 . . . . 0.0 110.045 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.68 -36.57 62.31 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.055 -1.028 . . . . 0.0 110.641 -179.924 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -97.94 -42.62 7.44 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.089 -1.007 . . . . 0.0 110.271 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 53.76 88.17 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.893 -1.129 . . . . 0.0 110.775 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.26 64.47 0.26 Allowed Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.8 ttpp . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.175 -1.191 . . . . 0.0 110.258 -180.0 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ttp . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.73 148.36 46.6 Favored 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.427 1.225 . . . . 0.0 110.29 179.92 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt 61.98 132.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.223 -0.923 . . . . 0.0 110.539 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.402 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 39.3 t80 -112.26 151.9 29.1 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.041 -1.037 . . . . 0.0 110.19 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -125.93 137.18 53.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.19 -0.944 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 36.2 t -114.77 92.37 3.92 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.213 -0.929 . . . . 0.0 110.061 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -51.45 -35.94 41.87 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.093 -1.004 . . . . 0.0 110.361 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.675 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -60.0 -31.08 69.59 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.138 -0.976 . . . . 0.0 110.008 178.882 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' HG22 ' A' ' 11' ' ' THR . 32.1 m -98.9 0.84 44.96 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.002 -1.061 . . . . 0.0 112.237 179.916 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.1 38.34 23.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.315 -1.491 . . . . 0.0 110.679 -179.662 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.423 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.0 t -146.61 171.68 14.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.987 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.401 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER -125.94 126.5 44.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.251 -179.73 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -77.32 167.43 21.72 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.173 -0.955 . . . . 0.0 109.885 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.1 t -100.15 -30.49 11.9 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.137 -0.977 . . . . 0.0 111.635 -179.702 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.472 ' HB2' HG11 ' A' ' 20' ' ' VAL . 35.6 m-70 -110.4 144.63 38.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.772 -1.205 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -121.87 95.31 4.61 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.77 177.93 1.67 Allowed Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.192 -0.943 . . . . 0.0 110.158 -179.578 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.2 Cg_endo -71.16 -32.41 13.09 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.396 1.209 . . . . 0.0 110.916 179.859 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 t -87.4 -40.02 14.75 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.974 -1.079 . . . . 0.0 110.0 179.588 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.472 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.1 t -61.11 -45.62 98.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.131 -0.981 . . . . 0.0 109.612 179.724 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 46.8 mtt180 -60.0 -53.79 53.71 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.096 -1.002 . . . . 0.0 109.483 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -59.79 -39.51 85.2 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.142 -0.974 . . . . 0.0 109.026 178.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.7 m -55.31 -42.79 74.19 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.075 -1.016 . . . . 0.0 108.517 178.359 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -63.12 -37.05 85.67 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.153 178.116 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 49.01 1.02 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.116 -0.99 . . . . 0.0 110.509 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 m -115.51 38.6 3.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.104 -0.997 . . . . 0.0 110.182 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.2 126.03 2.4 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.8 ttm-85 -53.31 -29.18 32.28 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.115 -1.226 . . . . 0.0 110.398 179.046 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 -33.92 70.14 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.042 -1.036 . . . . 0.0 110.654 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -51.34 -38.92 55.67 Favored 'General case' 0 N--CA 1.516 2.84 0 O-C-N 120.908 -1.12 . . . . 0.0 110.603 -179.591 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -62.99 -53.85 47.53 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.089 179.265 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.49 -39.26 87.05 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.22 -0.925 . . . . 0.0 108.956 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.52 -39.07 70.06 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.212 -0.93 . . . . 0.0 110.083 179.208 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.675 HG13 ' CD2' ' A' ' 8' ' ' TYR . 76.4 t -60.17 -36.44 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.071 -1.018 . . . . 0.0 109.761 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 61.2 tttp -52.75 -40.35 63.01 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.974 -1.078 . . . . 0.0 109.993 179.565 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.87 -33.44 68.7 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 179.12 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -63.94 -52.63 58.88 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.082 -1.011 . . . . 0.0 109.961 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.588 ' HE2' HG12 ' A' ' 34' ' ' VAL . 48.8 p90 -100.34 33.72 2.59 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.142 -0.973 . . . . 0.0 111.109 179.631 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -81.39 -38.81 25.96 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.781 -1.199 . . . . 0.0 110.181 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -117.08 21.21 13.37 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.244 -0.91 . . . . 0.0 111.636 179.791 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.6 t90 -59.85 -40.0 87.09 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.827 -1.171 . . . . 0.0 110.038 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.507 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 4.6 mtm -149.9 37.99 0.73 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -0.968 . . . . 0.0 110.59 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.16 38.18 20.32 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.0 -1.063 . . . . 0.0 110.975 179.924 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -145.99 -172.98 4.04 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.252 -0.905 . . . . 0.0 110.418 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -113.58 125.12 53.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 110.121 179.873 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -124.29 76.17 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.208 -0.932 . . . . 0.0 110.311 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.44 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -106.74 36.15 2.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.178 -0.951 . . . . 0.0 110.379 179.479 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -113.12 -54.9 2.58 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.214 -0.928 . . . . 0.0 109.571 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -22.01 61.55 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.186 -0.946 . . . . 0.0 111.463 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.561 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -68.34 -47.13 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 120.606 -1.309 . . . . 0.0 109.371 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -57.54 -36.7 71.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.155 -0.966 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -77.18 -34.81 56.24 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.016 -1.053 . . . . 0.0 110.643 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.4 m -82.53 -38.62 23.52 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.034 -1.041 . . . . 0.0 110.26 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.9 p -56.97 -37.52 71.71 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.09 -1.006 . . . . 0.0 110.452 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.95 -39.6 29.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.096 -1.003 . . . . 0.0 109.923 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.03 64.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.052 -1.03 . . . . 0.0 110.578 179.829 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -91.24 -40.24 11.64 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.098 -1.001 . . . . 0.0 110.208 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -59.53 -57.25 13.79 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.159 -0.963 . . . . 0.0 110.066 -179.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -140.84 -59.63 0.51 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.23 -0.918 . . . . 0.0 110.276 -179.896 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.17 42.18 4.39 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.204 -1.174 . . . . 0.0 110.216 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ptt? . . . . . 0 N--CA 1.5 2.033 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.97 79.76 1.61 Allowed 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.272 1.143 . . . . 0.0 110.285 179.868 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 30.3 mttp -136.4 151.07 49.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.296 -0.877 . . . . 0.0 110.113 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.614 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.4 t80 -109.62 161.86 14.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.219 -0.926 . . . . 0.0 110.118 179.991 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -136.51 135.33 38.44 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.141 -0.974 . . . . 0.0 110.24 -179.611 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -116.84 92.72 3.94 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.146 -0.971 . . . . 0.0 110.001 179.463 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -51.78 -35.77 45.05 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.014 -1.054 . . . . 0.0 110.408 179.805 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.5 m-85 -60.04 -32.95 71.39 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.133 -0.979 . . . . 0.0 110.004 179.008 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 m -95.54 -2.83 47.71 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.051 -1.031 . . . . 0.0 112.254 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.23 39.71 30.12 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.324 -1.485 . . . . 0.0 110.399 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -145.66 171.4 14.77 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.359 -0.838 . . . . 0.0 110.191 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 14.0 t80 -118.41 140.37 49.96 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.246 -0.909 . . . . 0.0 110.565 -179.517 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.614 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.3 mp -96.72 167.19 11.27 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.204 -0.935 . . . . 0.0 109.623 179.517 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.41 HG23 ' CG ' ' A' ' 15' ' ' HIS . 13.9 t -100.05 -29.81 12.32 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.847 -179.488 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.694 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.4 m170 -113.0 147.58 36.87 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.742 -1.223 . . . . 0.0 110.379 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -126.55 93.93 3.92 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.238 -0.914 . . . . 0.0 109.789 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -146.61 177.83 1.64 Allowed Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.194 -0.941 . . . . 0.0 110.277 -179.598 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -69.95 -27.66 25.31 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.383 1.202 . . . . 0.0 111.154 179.824 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.75 -39.0 12.04 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.92 -1.113 . . . . 0.0 110.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.694 HG11 ' HB2' ' A' ' 15' ' ' HIS . 80.8 t -62.93 -49.26 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.001 -1.062 . . . . 0.0 109.562 179.809 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -57.55 -48.43 79.33 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.141 -0.975 . . . . 0.0 109.635 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.0 -41.26 97.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.196 -0.94 . . . . 0.0 108.725 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.4 m -54.21 -43.22 70.61 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.18 -0.95 . . . . 0.0 108.439 178.336 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -63.19 -39.39 94.52 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 119.636 -0.826 . . . . 0.0 108.871 177.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -95.3 53.61 1.53 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.223 -0.923 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.55 37.83 3.79 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.094 -1.004 . . . . 0.0 110.33 179.859 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.79 126.62 2.31 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -28.54 46.48 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.129 -1.218 . . . . 0.0 110.102 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -57.14 -33.05 67.0 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.002 -1.061 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -49.36 -37.87 26.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.99 -1.069 . . . . 0.0 110.915 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -59.65 -56.38 22.58 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.096 -1.002 . . . . 0.0 109.479 179.465 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.25 -38.89 81.15 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.227 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.54 -36.69 69.53 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.106 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.865 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.3 t -55.65 -35.46 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.056 -1.028 . . . . 0.0 110.31 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.5 mtpt -52.93 -40.38 63.56 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.879 -1.138 . . . . 0.0 110.115 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.97 -29.95 63.67 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 179.11 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.61 -53.31 23.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.907 -1.121 . . . . 0.0 110.094 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 41.1 p90 -100.2 36.01 1.96 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.117 -0.99 . . . . 0.0 111.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.71 -36.76 23.46 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.705 -1.247 . . . . 0.0 110.359 179.144 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mttp -104.8 23.63 13.15 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.217 -0.927 . . . . 0.0 111.229 179.564 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.474 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.3 t90 -105.19 -49.87 3.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.886 -1.134 . . . . 0.0 110.414 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.474 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -104.94 -47.97 3.87 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.142 -0.974 . . . . 0.0 110.38 179.939 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 54.62 38.62 30.25 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.917 -1.114 . . . . 0.0 110.628 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -151.77 -65.94 0.18 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.21 -0.931 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.35 82.41 0.41 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.165 -0.959 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.64 73.04 1.5 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.372 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -121.12 33.67 5.47 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.157 -0.964 . . . . 0.0 110.609 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -50.44 3.04 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.027 -1.046 . . . . 0.0 109.825 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -21.08 63.5 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.179 -0.95 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.842 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.36 -38.73 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 O-C-N 120.673 -1.267 . . . . 0.0 109.944 179.742 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -83.55 -39.21 20.69 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.121 -0.987 . . . . 0.0 110.079 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -37.89 89.06 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.132 -0.98 . . . . 0.0 110.007 179.596 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.0 m -77.21 -35.89 55.26 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.079 -1.013 . . . . 0.0 110.287 179.756 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.531 HG23 ' O ' ' A' ' 50' ' ' ILE . 82.0 p -81.3 -40.0 24.33 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.053 -1.029 . . . . 0.0 110.066 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.26 -39.2 82.14 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.168 -0.957 . . . . 0.0 110.118 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.17 -39.2 72.01 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.169 -0.957 . . . . 0.0 110.413 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.91 -67.6 0.42 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.179 -0.951 . . . . 0.0 109.841 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 51.48 53.75 12.26 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.044 -1.035 . . . . 0.0 110.85 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -128.06 73.69 1.49 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.181 -0.949 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.1 -108.99 2.92 Favored Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 mttp . . . . . 0 N--CA 1.494 1.731 0 O-C-N 121.303 -1.116 . . . . 0.0 110.174 -179.975 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.402 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 4.1 mtp . . . . . 0 N--CA 1.505 2.307 0 CA-C-O 119.896 -0.097 . . . . 0.0 110.894 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD3' ' HB2' ' A' ' 1' ' ' MET . 48.2 Cg_endo -73.94 99.37 1.16 Allowed 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.131 1.069 . . . . 0.0 110.52 -179.861 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 53.8 mttp -131.88 153.77 49.88 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.24 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.68 ' HD2' HD13 ' A' ' 13' ' ' LEU . 67.5 t80 -110.14 161.73 15.28 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.226 -0.921 . . . . 0.0 110.06 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -125.44 133.91 52.29 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.25 99.75 7.84 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.068 -1.02 . . . . 0.0 110.003 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -52.74 -36.02 56.99 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 120.977 -1.077 . . . . 0.0 110.548 179.942 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 94.9 m-85 -62.8 -30.43 71.46 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.097 -1.002 . . . . 0.0 110.267 179.243 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 50.0 m -99.84 -12.04 20.23 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.981 -1.074 . . . . 0.0 111.979 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.5 t70 57.14 41.88 26.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.405 -1.434 . . . . 0.0 109.972 -179.42 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -143.73 174.23 10.98 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 5.7 t80 -115.8 112.72 22.4 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.274 -0.892 . . . . 0.0 110.46 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.697 HD21 ' ND1' ' A' ' 24' ' ' HIS . 3.6 mp -65.91 171.27 4.57 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.233 -0.917 . . . . 0.0 109.713 179.688 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.433 HG23 ' CG ' ' A' ' 15' ' ' HIS . 13.5 t -97.34 -30.1 13.14 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.235 -0.916 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 31.9 m170 -115.45 148.87 38.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.952 -1.092 . . . . 0.0 110.34 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -126.45 93.97 3.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 109.692 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -147.24 178.87 1.3 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.201 -0.937 . . . . 0.0 110.082 -179.641 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.58 -31.18 13.89 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.326 1.172 . . . . 0.0 110.971 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 t -88.13 -38.78 15.08 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.958 -1.089 . . . . 0.0 110.029 179.443 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 64.3 t -61.89 -45.84 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 121.081 -1.012 . . . . 0.0 109.416 179.568 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 24.5 mtt180 -59.35 -52.24 66.48 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.464 179.768 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -41.02 97.9 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.858 178.918 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -56.19 -43.22 78.25 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.098 -1.001 . . . . 0.0 108.564 178.249 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.697 ' ND1' HD21 ' A' ' 13' ' ' LEU . 64.8 t60 -61.71 -34.56 76.01 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.27 178.086 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -100.47 40.35 1.27 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.071 -1.018 . . . . 0.0 110.633 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 28.8 m -116.27 38.5 3.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.171 -0.956 . . . . 0.0 110.003 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.65 129.93 4.53 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -54.57 -28.56 46.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.189 -1.183 . . . . 0.0 110.403 179.155 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -60.07 -36.85 78.27 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.964 -1.085 . . . . 0.0 110.475 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -51.38 -36.37 43.02 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 120.942 -1.099 . . . . 0.0 110.632 -179.704 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -55.57 -52.03 65.1 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.0 -1.063 . . . . 0.0 109.768 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -61.11 -40.53 94.09 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.405 -0.918 . . . . 0.0 108.996 178.778 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -56.56 -37.07 70.03 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.252 -0.905 . . . . 0.0 110.3 179.171 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 50' ' ' ILE . 97.6 t -64.94 -37.02 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.083 -1.011 . . . . 0.0 110.048 179.8 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.1 tppt? -53.71 -42.43 68.04 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 120.83 -1.169 . . . . 0.0 109.925 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.66 -28.04 65.34 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.424 179.067 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -72.86 -51.54 18.33 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.893 -1.129 . . . . 0.0 110.528 -179.752 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.2 p90 -99.63 35.4 2.0 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.03 -1.044 . . . . 0.0 111.415 179.97 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.68 -39.11 15.27 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.828 -1.17 . . . . 0.0 109.98 178.85 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -116.72 34.22 5.18 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.252 -0.905 . . . . 0.0 110.599 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.4 t90 -91.51 -39.03 12.16 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.175 -0.953 . . . . 0.0 110.282 -179.853 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 mtm -154.32 -67.24 0.14 Allowed 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.121 -0.987 . . . . 0.0 110.579 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -135.05 -171.82 2.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.192 -0.943 . . . . 0.0 110.126 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -110.12 39.42 2.16 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.0 110.154 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -146.7 74.33 1.35 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.162 -0.961 . . . . 0.0 110.266 179.876 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.41 73.35 1.37 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.95 35.06 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.113 -0.992 . . . . 0.0 110.502 179.58 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 59.9 p -109.71 -53.48 2.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.149 -0.969 . . . . 0.0 109.473 179.265 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -20.96 63.48 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.216 -0.928 . . . . 0.0 111.339 179.205 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 34' ' ' VAL . 49.0 mm -74.33 -47.21 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.66 -1.275 . . . . 0.0 109.701 179.628 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.449 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 8.2 t0 -58.27 -40.03 80.81 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.214 -0.928 . . . . 0.0 110.068 179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.826 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 28.1 mttm -57.41 -35.91 70.65 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.577 179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.4 m -90.89 -39.04 12.52 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.965 -1.084 . . . . 0.0 110.394 179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.449 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 72.3 p -70.98 -35.51 72.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.1 -1.0 . . . . 0.0 110.33 179.641 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.58 -42.37 10.83 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.112 -0.993 . . . . 0.0 110.151 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.826 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.3 56.51 2.18 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.162 -0.961 . . . . 0.0 110.303 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -92.6 -56.62 2.95 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.191 -0.943 . . . . 0.0 110.064 179.716 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -144.75 72.63 1.34 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? 52.89 73.46 0.35 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.08 -1.013 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.29 -107.55 3.11 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 O-C-N 121.178 -1.189 . . . . 0.0 110.247 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.82 171.16 17.95 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 O-C-N 123.284 1.149 . . . . 0.0 110.501 -179.966 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.1 mttt -113.16 155.31 25.21 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.297 -0.877 . . . . 0.0 110.201 -179.951 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -115.23 159.47 20.93 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.191 -0.943 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -136.61 139.48 42.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.099 -1.001 . . . . 0.0 110.7 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.1 t -112.23 96.98 6.33 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.896 . . . . 0.0 110.105 179.519 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -54.8 -36.43 64.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.056 -1.028 . . . . 0.0 110.339 179.865 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.864 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.0 m-85 -60.44 -32.08 71.02 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.117 -0.989 . . . . 0.0 110.049 179.23 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.7 m -96.91 -2.74 43.16 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.957 -1.089 . . . . 0.0 112.14 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 53.77 38.69 29.08 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.397 -1.44 . . . . 0.0 110.475 -179.545 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -140.1 174.85 10.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -0.912 . . . . 0.0 109.899 179.894 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.79 121.77 38.9 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.268 -0.895 . . . . 0.0 110.258 -179.633 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -80.52 166.51 21.11 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.043 -1.036 . . . . 0.0 109.544 179.371 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.0 t -100.89 -29.5 12.19 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.125 -0.984 . . . . 0.0 111.891 -179.535 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.68 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.0 m170 -112.23 146.79 37.52 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.824 -1.173 . . . . 0.0 110.276 -179.821 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -125.13 93.51 3.9 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 109.849 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.21 178.68 1.36 Allowed Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.39 -31.27 14.26 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.267 1.14 . . . . 0.0 110.87 179.888 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -87.16 -40.15 14.86 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.937 -1.102 . . . . 0.0 109.979 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 15' ' ' HIS . 85.3 t -61.57 -49.03 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 121.183 -0.948 . . . . 0.0 109.476 179.655 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.6 mtp-105 -58.39 -50.76 72.51 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.53 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -62.08 -41.16 97.9 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.111 -0.993 . . . . 0.0 108.803 178.803 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.4 m -55.67 -43.38 76.3 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.13 -0.981 . . . . 0.0 108.451 178.376 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -62.33 -38.76 90.72 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.404 -0.81 . . . . 0.0 108.922 178.02 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -92.7 55.86 2.53 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.227 -0.921 . . . . 0.0 110.31 -179.988 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.98 37.4 4.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.055 -1.028 . . . . 0.0 110.326 179.789 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.28 128.64 3.46 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.0 ttp-105 -54.64 -28.12 44.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.171 -1.193 . . . . 0.0 110.639 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -62.47 -34.1 76.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.929 -1.107 . . . . 0.0 110.574 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.7 t-80 -51.58 -41.78 61.43 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.946 -1.096 . . . . 0.0 110.583 -179.595 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -62.54 -54.65 36.7 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.091 179.31 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -39.15 83.9 Favored 'General case' 0 N--CA 1.508 2.471 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.117 178.572 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -55.94 -38.18 69.97 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.227 -0.92 . . . . 0.0 110.069 179.172 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.864 HG13 ' CD1' ' A' ' 8' ' ' TYR . 95.2 t -65.95 -34.51 70.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.148 -0.97 . . . . 0.0 110.025 179.61 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 25.4 tttt -52.14 -39.92 60.64 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.909 -1.119 . . . . 0.0 109.983 179.431 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -59.07 -29.49 67.37 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 178.903 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -71.72 -53.09 14.6 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.862 -1.149 . . . . 0.0 110.278 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.687 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 37.0 p90 -99.27 32.0 2.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.068 -1.02 . . . . 0.0 111.448 179.852 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.47 -38.94 54.59 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.728 -1.232 . . . . 0.0 110.138 179.166 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.11 31.28 5.83 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.212 -0.93 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.8 t90 -108.51 -57.42 2.13 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.073 -1.017 . . . . 0.0 110.404 -179.758 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.461 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.5 OUTLIER -123.11 54.05 1.27 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.232 -0.918 . . . . 0.0 110.015 -179.989 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 -171.36 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.022 -1.049 . . . . 0.0 110.581 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -82.29 -172.86 4.23 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.163 -0.961 . . . . 0.0 110.0 179.987 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 54.76 73.89 0.38 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.015 -1.053 . . . . 0.0 110.493 -179.801 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.687 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -148.97 69.99 1.09 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.202 -0.936 . . . . 0.0 110.413 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -114.0 33.94 4.94 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.274 -0.891 . . . . 0.0 110.589 179.62 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -105.9 -51.6 2.96 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.053 -1.03 . . . . 0.0 109.309 179.198 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.4 -21.65 62.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.239 -0.913 . . . . 0.0 111.355 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.736 HD12 HG11 ' A' ' 34' ' ' VAL . 50.1 mm -79.27 -46.31 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.595 -1.316 . . . . 0.0 109.741 179.633 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.72 -37.62 82.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.741 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 13.1 tptt -75.74 -35.53 60.18 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.148 -0.97 . . . . 0.0 110.584 179.946 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.9 m -82.81 -39.92 21.08 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.08 -1.012 . . . . 0.0 110.071 179.852 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 50' ' ' ILE . 33.6 p -58.95 -39.08 80.56 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.126 -0.984 . . . . 0.0 110.206 179.874 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.36 -42.37 9.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.166 -0.959 . . . . 0.0 110.003 179.674 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.741 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.88 55.47 1.86 Allowed 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.091 -1.006 . . . . 0.0 110.293 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -92.95 -50.6 5.46 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.213 -0.93 . . . . 0.0 110.217 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -119.03 48.19 1.53 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.215 -0.928 . . . . 0.0 110.32 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 52.53 79.64 0.11 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.034 -1.041 . . . . 0.0 110.801 179.95 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -107.97 -54.57 0.63 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.4 tttp . . . . . 0 N--CA 1.494 1.759 0 O-C-N 121.25 -1.147 . . . . 0.0 110.17 179.949 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mtt . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.43 160.27 44.93 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.377 1.199 . . . . 0.0 110.358 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.448 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 26.3 mttt 55.07 100.3 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.186 -0.946 . . . . 0.0 110.67 -179.995 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.626 ' HD1' HD13 ' A' ' 13' ' ' LEU . 55.6 t80 -54.65 156.73 3.35 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.089 -1.007 . . . . 0.0 110.937 -179.553 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -137.75 129.75 28.82 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.36 -0.838 . . . . 0.0 109.145 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.2 t -109.99 92.69 4.15 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.024 -1.047 . . . . 0.0 110.523 179.89 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.13 -35.35 59.59 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.059 -1.026 . . . . 0.0 110.201 179.327 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.828 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -60.44 -34.43 73.97 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.109 -0.995 . . . . 0.0 109.941 179.14 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.8 m -96.27 -0.29 49.9 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.089 -1.007 . . . . 0.0 112.136 -179.922 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.55 38.57 26.07 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.365 -1.459 . . . . 0.0 110.678 -179.755 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -139.56 166.97 23.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.979 . . . . 0.0 110.042 179.9 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.448 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 22.4 t80 -120.35 127.11 52.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.211 -0.931 . . . . 0.0 110.22 -179.712 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.626 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -84.86 167.58 15.87 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.527 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.459 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.3 t -99.47 -31.62 11.55 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.114 -0.991 . . . . 0.0 111.708 -179.34 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.459 ' CG ' HG23 ' A' ' 14' ' ' THR . 29.8 m170 -117.72 139.43 51.05 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.899 -1.126 . . . . 0.0 110.278 -179.872 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -114.66 94.18 4.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.215 -0.928 . . . . 0.0 109.821 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -139.21 178.72 1.52 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.292 -0.88 . . . . 0.0 110.072 -179.653 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.76 -32.2 14.81 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.351 1.185 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.72 -44.4 11.83 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.966 -1.084 . . . . 0.0 109.737 179.44 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.2 t -60.43 -51.35 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 121.17 -0.956 . . . . 0.0 109.552 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -58.49 -50.47 73.62 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.084 -1.01 . . . . 0.0 109.393 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -61.32 -40.12 93.05 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.874 178.77 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 68.9 m -54.07 -42.87 69.78 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.105 -0.997 . . . . 0.0 108.562 178.262 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -63.06 -39.85 95.93 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.361 -0.837 . . . . 0.0 108.898 178.135 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.81 56.64 2.35 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.32 -0.862 . . . . 0.0 110.089 -179.912 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.95 37.74 3.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.154 -0.966 . . . . 0.0 110.362 179.892 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -149.51 124.59 1.82 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.991 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -28.31 39.13 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.075 -1.25 . . . . 0.0 110.4 178.946 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -60.07 -31.34 69.92 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.948 -1.095 . . . . 0.0 110.691 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.508 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.1 t-80 -49.04 -38.1 22.87 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.91 -1.119 . . . . 0.0 110.986 -179.499 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.21 -54.66 29.96 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.014 179.284 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -60.91 -39.28 88.75 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.034 178.703 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -55.94 -37.04 68.44 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.191 -0.943 . . . . 0.0 110.075 179.15 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.828 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.1 t -55.22 -36.44 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.635 0 O-C-N 121.033 -1.042 . . . . 0.0 110.035 179.769 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.4 tttt -57.6 -42.24 82.84 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 120.969 -1.082 . . . . 0.0 109.481 179.309 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -59.18 -26.86 65.17 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.305 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -70.12 -52.52 23.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.893 -1.129 . . . . 0.0 110.406 -179.924 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.538 ' HE1' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -97.45 20.94 10.85 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.036 -1.04 . . . . 0.0 111.947 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -61.48 -40.0 92.97 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.6 -1.312 . . . . 0.0 109.848 179.192 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.22 31.38 6.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.23 -0.919 . . . . 0.0 110.875 179.723 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CE2' ' HE1' ' A' ' 42' ' ' MET . 24.2 t90 -77.29 -59.17 2.89 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.133 -0.979 . . . . 0.0 110.316 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.427 ' HE1' ' CE2' ' A' ' 41' ' ' TRP . 7.1 tpp -137.52 -59.55 0.67 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.121 -0.987 . . . . 0.0 110.539 -179.788 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -114.86 -173.54 2.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.162 -0.961 . . . . 0.0 110.411 -179.797 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -97.49 -35.78 10.54 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.27 -0.894 . . . . 0.0 110.849 -179.946 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -106.13 83.79 1.95 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.93 -1.106 . . . . 0.0 110.399 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.505 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -115.47 70.41 0.75 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.247 -0.908 . . . . 0.0 109.873 179.715 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.66 34.86 4.53 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.199 -0.938 . . . . 0.0 110.54 179.847 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 t -107.49 -53.78 2.57 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.087 -1.008 . . . . 0.0 109.213 179.118 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.17 -20.7 64.41 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.307 -0.87 . . . . 0.0 111.31 179.109 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.57 ' O ' HG23 ' A' ' 54' ' ' THR . 49.4 mm -77.58 -40.64 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 120.731 -1.231 . . . . 0.0 109.894 179.797 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -58.53 -38.65 78.22 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.175 -0.953 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -73.46 -37.35 65.83 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.157 -0.964 . . . . 0.0 110.202 179.772 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.3 m -76.29 -35.96 58.62 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.045 -1.035 . . . . 0.0 110.366 179.742 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.57 HG23 ' O ' ' A' ' 50' ' ' ILE . 60.1 p -76.63 -42.88 40.57 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.001 -1.062 . . . . 0.0 109.983 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.7 96.37 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.179 -0.951 . . . . 0.0 109.871 -179.981 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -98.38 32.88 2.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 111.348 179.672 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.88 -45.27 8.05 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.895 -1.128 . . . . 0.0 110.236 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -123.6 54.29 1.3 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.159 -0.963 . . . . 0.0 110.386 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -127.45 -58.61 1.25 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.115 -0.991 . . . . 0.0 110.293 179.886 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.18 95.14 1.48 Allowed Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt . . . . . 0 N--CA 1.494 1.753 0 O-C-N 121.244 -1.151 . . . . 0.0 110.17 179.93 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.77 116.51 4.73 Favored 'Trans proline' 0 C--N 1.317 -1.08 0 O-C-N 123.369 1.194 . . . . 0.0 110.535 179.999 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.41 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 5.8 mtmm -145.55 139.02 26.44 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.193 -0.942 . . . . 0.0 110.248 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 13' ' ' LEU . 64.6 t80 -111.28 157.86 19.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.158 -0.964 . . . . 0.0 110.141 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -125.95 135.72 52.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.164 -0.96 . . . . 0.0 110.62 -179.755 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.3 t -113.34 95.0 5.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.188 -0.945 . . . . 0.0 110.019 179.495 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -53.03 -36.08 60.15 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.062 -1.024 . . . . 0.0 110.478 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.836 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.0 m-85 -60.19 -32.96 71.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.088 -1.007 . . . . 0.0 109.927 179.108 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' HG22 ' A' ' 11' ' ' THR . 25.1 m -95.47 -0.08 52.7 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.011 -1.056 . . . . 0.0 112.061 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.95 38.57 24.06 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.435 -1.416 . . . . 0.0 110.635 -179.783 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.6 t -148.9 171.15 16.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.291 -0.881 . . . . 0.0 110.149 179.933 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -117.36 124.94 50.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.198 -0.939 . . . . 0.0 110.238 -179.664 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.479 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.3 mp -74.2 170.16 16.11 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.132 -0.98 . . . . 0.0 109.784 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.541 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.6 t -101.02 -21.36 15.05 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.236 -0.915 . . . . 0.0 112.176 -179.712 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.716 ' HB2' HG11 ' A' ' 20' ' ' VAL . 48.9 m-70 -119.4 147.28 44.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.53 -1.356 . . . . 0.0 110.291 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -124.47 94.84 4.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.22 -0.925 . . . . 0.0 109.961 179.813 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.67 177.4 1.79 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.187 -0.946 . . . . 0.0 110.413 -179.625 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.86 -32.71 13.58 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.41 1.216 . . . . 0.0 110.845 179.849 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 m -87.26 -38.95 15.84 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.043 -1.036 . . . . 0.0 110.027 179.552 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.716 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.0 t -60.38 -49.31 84.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 179.645 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.405 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 19.9 mtt180 -58.26 -50.81 72.29 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.079 -1.013 . . . . 0.0 109.605 179.648 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.57 -41.33 98.87 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.346 -0.941 . . . . 0.0 108.748 178.825 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.5 m -55.96 -43.29 77.36 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.221 -0.924 . . . . 0.0 108.625 178.416 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.479 ' ND1' HD21 ' A' ' 13' ' ' LEU . 76.4 t60 -61.79 -36.25 80.55 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.701 -0.8 . . . . 0.0 109.199 178.218 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.14 52.31 1.28 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.135 -0.978 . . . . 0.0 110.274 -179.813 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -116.49 37.98 3.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.244 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.12 127.1 2.77 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 -179.981 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.7 ttt-85 -54.93 -28.05 47.98 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.097 -1.237 . . . . 0.0 110.342 179.179 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -60.05 -34.45 73.42 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.957 -1.09 . . . . 0.0 110.507 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.651 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.2 t-80 -51.09 -39.1 55.31 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.948 -1.095 . . . . 0.0 110.537 -179.484 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -63.19 -55.37 25.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.101 -1.0 . . . . 0.0 109.084 179.328 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.95 -39.23 84.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.23 -0.919 . . . . 0.0 109.199 178.701 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -56.94 -38.18 72.56 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.217 -0.927 . . . . 0.0 110.036 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.836 HG13 ' CD2' ' A' ' 8' ' ' TYR . 90.0 t -58.19 -35.21 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.154 -0.966 . . . . 0.0 110.067 179.684 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.9 ttmt -52.27 -40.52 61.87 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.969 -1.082 . . . . 0.0 109.952 179.535 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -58.13 -29.95 65.95 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.577 -0.849 . . . . 0.0 110.298 178.96 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -69.2 -52.8 24.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.877 -1.14 . . . . 0.0 110.042 179.909 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.7 p90 -100.35 35.83 2.02 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.138 -0.976 . . . . 0.0 111.083 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -38.08 16.32 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.799 -1.188 . . . . 0.0 110.044 178.921 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -107.47 26.75 9.85 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.1 t90 -106.74 -55.99 2.25 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.966 -1.084 . . . . 0.0 109.893 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 1.3 mtm -128.64 55.43 1.7 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.252 -0.905 . . . . 0.0 109.713 179.711 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 55.8 -163.48 0.15 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.933 -1.104 . . . . 0.0 110.337 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -99.74 48.94 0.93 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.13 -0.981 . . . . 0.0 110.221 179.92 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -140.11 73.06 1.41 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.212 -0.93 . . . . 0.0 109.959 179.736 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.79 73.4 0.62 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.272 -0.892 . . . . 0.0 110.793 -179.823 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -112.51 35.3 3.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.16 -0.962 . . . . 0.0 110.434 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -109.06 -52.72 2.73 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.112 -0.992 . . . . 0.0 109.586 179.289 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.47 -20.93 63.7 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.232 -0.918 . . . . 0.0 111.464 179.335 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.756 HD12 HG11 ' A' ' 34' ' ' VAL . 48.7 mm -74.67 -45.95 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 120.747 -1.221 . . . . 0.0 109.835 179.842 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 43.5 m-20 -65.4 -40.7 93.76 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.229 -0.919 . . . . 0.0 110.067 -179.938 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -58.32 -36.75 73.85 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.147 -0.971 . . . . 0.0 110.532 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -91.4 -39.16 12.15 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.018 -1.052 . . . . 0.0 110.422 179.91 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.604 HG23 ' O ' ' A' ' 50' ' ' ILE . 68.8 p -69.03 -37.51 78.65 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.063 -1.023 . . . . 0.0 110.299 179.941 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.93 -43.26 36.09 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.052 -1.03 . . . . 0.0 109.979 179.9 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -34.79 64.41 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.012 -1.055 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -91.51 -31.74 15.84 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.01 -1.057 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -97.46 -54.58 3.09 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.882 -1.136 . . . . 0.0 110.491 -179.862 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -114.87 48.57 1.13 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.152 -0.968 . . . . 0.0 110.297 -179.898 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -124.94 -110.56 1.83 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.973 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.214 -1.168 . . . . 0.0 110.165 179.991 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.21 149.9 46.61 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.488 1.257 . . . . 0.0 110.55 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt -129.18 168.4 16.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.223 -0.923 . . . . 0.0 109.985 179.891 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -111.46 160.87 16.71 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.19 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -143.68 131.15 21.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.161 -0.962 . . . . 0.0 110.375 -179.48 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.0 t -109.93 87.1 2.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.154 -0.967 . . . . 0.0 109.684 179.13 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -50.37 -35.71 29.24 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.11 -0.994 . . . . 0.0 110.937 -179.562 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.843 ' CD2' HG13 ' A' ' 34' ' ' VAL . 25.5 m-85 -61.82 -30.64 70.96 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.084 -1.01 . . . . 0.0 109.919 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.1 m -98.48 0.52 45.3 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.943 -1.098 . . . . 0.0 112.058 179.674 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 52.89 38.08 25.96 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.395 -1.44 . . . . 0.0 110.839 -179.881 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -139.4 168.93 18.71 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.191 -0.943 . . . . 0.0 109.999 179.571 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -121.83 140.27 52.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.175 -0.953 . . . . 0.0 110.886 -179.69 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -106.44 152.63 23.38 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.247 -0.908 . . . . 0.0 109.39 179.302 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.485 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -99.1 -30.71 12.15 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.113 -0.992 . . . . 0.0 111.693 -179.519 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.485 ' CD2' HG23 ' A' ' 14' ' ' THR . 50.3 m-70 -111.46 125.3 53.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.823 -1.173 . . . . 0.0 110.189 179.989 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -110.2 88.53 2.78 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.114 -0.991 . . . . 0.0 109.742 179.679 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -133.24 -179.78 1.17 Allowed Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 109.81 -179.602 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -71.05 -26.97 20.97 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.271 1.142 . . . . 0.0 111.238 179.885 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.0 m -90.17 -40.22 12.35 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.742 -1.224 . . . . 0.0 110.053 179.482 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.6 t -69.04 -48.35 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.06 -1.025 . . . . 0.0 109.699 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -59.06 -51.42 70.1 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.079 -1.013 . . . . 0.0 109.467 179.77 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -59.32 -40.2 85.5 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.163 -0.961 . . . . 0.0 108.891 178.862 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 49.7 m -54.67 -43.02 72.06 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.07 -1.019 . . . . 0.0 108.303 178.301 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -66.09 -40.93 91.19 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.739 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.66 57.15 2.49 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.322 -0.861 . . . . 0.0 110.093 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -113.34 37.97 3.03 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.047 -1.033 . . . . 0.0 110.453 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.12 124.49 1.61 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -53.76 -28.72 36.31 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.157 -1.202 . . . . 0.0 110.27 179.068 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -59.33 -31.24 68.99 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 110.701 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.2 t-80 -48.85 -48.05 42.25 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.927 -1.108 . . . . 0.0 111.175 -179.382 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -58.86 -53.33 59.57 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.053 -1.029 . . . . 0.0 109.37 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.44 -38.98 85.86 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.163 -0.961 . . . . 0.0 109.036 178.556 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -56.46 -38.98 72.4 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.24 -0.912 . . . . 0.0 110.027 179.249 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.843 HG13 ' CD2' ' A' ' 8' ' ' TYR . 97.3 t -60.17 -38.03 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.092 -1.005 . . . . 0.0 109.76 179.747 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 27.3 ttmt -53.65 -39.73 65.28 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.961 -1.087 . . . . 0.0 109.97 179.441 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -58.63 -34.74 71.51 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.209 -0.932 . . . . 0.0 109.997 179.162 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -64.27 -52.47 58.49 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.036 -1.04 . . . . 0.0 109.931 179.867 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.4 p90 -100.6 35.43 2.15 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.118 -0.989 . . . . 0.0 110.991 179.491 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -84.61 -37.71 20.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.8 -1.187 . . . . 0.0 110.267 179.138 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -111.5 21.82 15.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.132 -0.98 . . . . 0.0 111.482 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.7 t90 -60.44 -46.91 88.35 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.861 -1.149 . . . . 0.0 109.963 179.949 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.5 mtm -151.68 36.74 0.57 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.155 -0.965 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 50.9 41.63 27.13 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.011 -1.055 . . . . 0.0 110.899 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.4 -168.03 2.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.162 -0.961 . . . . 0.0 110.318 -179.931 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -117.96 124.86 49.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -125.78 76.7 1.6 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.241 -0.912 . . . . 0.0 110.259 -179.898 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.81 35.71 3.26 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.201 -0.937 . . . . 0.0 110.57 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.3 t -112.77 -55.66 2.5 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.209 -0.932 . . . . 0.0 109.378 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -21.28 64.25 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.225 -0.922 . . . . 0.0 111.064 179.075 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.814 HD12 HG11 ' A' ' 34' ' ' VAL . 47.5 mm -69.92 -41.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.608 -1.307 . . . . 0.0 109.306 179.498 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -71.46 -37.04 71.4 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.19 -0.944 . . . . 0.0 110.327 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.669 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 62.1 mttt -80.3 -36.31 34.53 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.106 -0.996 . . . . 0.0 110.367 179.778 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.2 m -73.32 -37.4 66.17 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.08 -1.013 . . . . 0.0 110.339 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 50' ' ' ILE . 24.0 p -65.56 -40.02 92.35 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.047 -1.033 . . . . 0.0 110.289 -179.887 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.29 -40.55 10.88 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.187 -0.945 . . . . 0.0 110.194 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.669 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.36 53.46 1.5 Allowed 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.167 -0.958 . . . . 0.0 110.548 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.48 -41.45 10.27 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.141 -0.974 . . . . 0.0 109.852 179.521 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -131.47 39.9 3.46 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.288 -0.882 . . . . 0.0 110.2 179.887 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 52.49 41.03 30.78 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.997 -1.064 . . . . 0.0 110.823 -179.955 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.41 -109.59 3.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.982 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 tttt . . . . . 0 N--CA 1.495 1.789 0 O-C-N 121.202 -1.176 . . . . 0.0 110.212 179.982 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mtp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.95 115.28 4.29 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.404 1.213 . . . . 0.0 110.468 -179.964 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 18.2 mtmt -136.87 145.82 44.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.205 -0.934 . . . . 0.0 110.05 179.99 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.9 t80 -107.74 161.36 14.96 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.132 -0.98 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -133.83 134.25 42.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.251 -0.906 . . . . 0.0 110.157 -179.714 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.8 t -114.59 96.51 5.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.154 -0.966 . . . . 0.0 110.158 179.603 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.56 -35.99 61.36 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.985 -1.072 . . . . 0.0 110.385 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.813 ' CD2' HG13 ' A' ' 34' ' ' VAL . 92.6 m-85 -61.24 -32.57 72.37 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.033 -1.042 . . . . 0.0 110.132 179.222 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.4 m -97.08 -4.58 39.25 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.954 -1.091 . . . . 0.0 112.163 -179.982 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.47 39.67 30.3 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.371 -1.456 . . . . 0.0 110.442 -179.698 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.98 171.61 13.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.307 -0.871 . . . . 0.0 110.051 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.437 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 12.9 t80 -118.45 133.21 56.06 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.254 -0.904 . . . . 0.0 110.328 -179.753 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -89.11 165.65 14.36 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.185 -0.947 . . . . 0.0 109.752 179.588 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.6 t -98.83 -29.92 12.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.134 -0.979 . . . . 0.0 111.698 -179.567 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.744 ' HB2' HG11 ' A' ' 20' ' ' VAL . 32.5 m170 -111.05 146.36 36.87 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.877 -1.139 . . . . 0.0 110.189 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.11 93.19 3.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.453 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.3 178.69 1.37 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.234 -0.916 . . . . 0.0 110.172 -179.594 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.15 -30.72 15.71 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.442 1.233 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.73 -40.38 12.55 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.996 -1.065 . . . . 0.0 109.988 179.647 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.744 HG11 ' HB2' ' A' ' 15' ' ' HIS . 90.3 t -60.06 -50.46 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.641 179.813 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HD3' ' CE2' ' A' ' 4' ' ' PHE . 19.7 mtt180 -58.86 -50.75 72.85 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.684 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -61.66 -40.29 94.41 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.17 -0.957 . . . . 0.0 108.832 178.817 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -54.53 -43.31 71.81 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.1 -1.0 . . . . 0.0 108.358 178.223 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -62.48 -37.78 87.33 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.008 177.814 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.07 48.35 1.0 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.133 -0.98 . . . . 0.0 110.442 -179.82 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.01 38.02 3.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.118 -0.989 . . . . 0.0 110.241 179.757 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.54 128.17 3.28 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.1 ttm105 -54.61 -28.5 47.05 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.144 -1.209 . . . . 0.0 110.361 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -59.15 -35.56 73.71 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.883 -1.135 . . . . 0.0 110.392 179.772 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.667 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.7 t-80 -51.4 -39.1 56.53 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.023 -1.048 . . . . 0.0 110.5 -179.611 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -62.67 -55.6 25.36 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.136 -0.977 . . . . 0.0 109.128 179.406 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -60.13 -39.25 85.62 Favored 'General case' 0 N--CA 1.509 2.517 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.159 178.807 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -57.36 -37.14 72.15 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.301 -0.875 . . . . 0.0 110.053 179.232 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.974 HG11 HD12 ' A' ' 50' ' ' ILE . 73.0 t -56.86 -37.09 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.022 -1.049 . . . . 0.0 110.156 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.8 ttpt -54.13 -40.79 67.71 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.913 -1.117 . . . . 0.0 109.718 179.445 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.95 -28.63 66.46 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.359 178.911 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.74 -53.11 16.79 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.888 -1.132 . . . . 0.0 110.134 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.7 p90 -99.91 32.66 2.83 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.208 -0.933 . . . . 0.0 111.294 179.625 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -74.17 -35.97 64.05 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.73 -1.231 . . . . 0.0 110.258 179.184 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -107.28 27.0 9.51 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.121 -0.987 . . . . 0.0 111.091 179.61 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.448 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 10.6 t90 -109.45 -55.81 2.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.055 -1.028 . . . . 0.0 110.047 179.922 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.48 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 3.7 mtm -141.58 57.73 1.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.224 -0.923 . . . . 0.0 109.889 179.67 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -51.18 -36.21 40.0 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.056 -1.027 . . . . 0.0 110.97 -179.711 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -53.36 -58.69 6.22 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.966 -1.084 . . . . 0.0 110.511 -179.852 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.82 87.46 1.92 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.161 -0.962 . . . . 0.0 110.155 179.892 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -130.49 71.5 1.46 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.156 -0.965 . . . . 0.0 110.546 -179.888 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -144.3 34.89 1.2 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.162 -0.961 . . . . 0.0 110.573 179.426 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -53.42 2.65 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.204 -0.935 . . . . 0.0 109.393 179.192 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.24 65.04 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 111.249 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.974 HD12 HG11 ' A' ' 34' ' ' VAL . 51.1 mm -76.85 -51.97 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 120.647 -1.283 . . . . 0.0 109.787 179.806 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 71.1 m-20 -61.2 -39.66 91.04 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.239 -0.913 . . . . 0.0 110.116 179.884 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -57.12 -37.69 72.34 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.072 -1.018 . . . . 0.0 110.507 -179.794 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.483 HG22 ' HD2' ' A' ' 57' ' ' PHE . 59.9 m -92.46 -44.48 8.64 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.067 -1.021 . . . . 0.0 110.347 179.96 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 50' ' ' ILE . 74.3 p -61.25 -39.37 90.07 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 110.085 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.95 70.0 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.098 -1.001 . . . . 0.0 110.12 179.827 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.23 28.57 3.57 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.07 -1.019 . . . . 0.0 111.651 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.483 ' HD2' HG22 ' A' ' 53' ' ' THR . 1.2 t80 -92.93 -40.39 10.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.788 -1.195 . . . . 0.0 109.978 179.637 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -108.9 -51.77 2.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.203 -0.936 . . . . 0.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 54.35 51.61 13.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.005 -1.059 . . . . 0.0 110.638 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.19 44.69 1.44 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.933 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.196 -1.179 . . . . 0.0 110.203 -179.923 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 ptt? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.52 169.91 20.67 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.439 1.231 . . . . 0.0 110.386 179.954 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.7 mttt 55.55 170.89 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.308 -0.87 . . . . 0.0 110.713 -179.964 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -123.78 162.38 23.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.15 -0.969 . . . . 0.0 110.308 -179.441 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -138.15 134.19 34.26 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.205 -0.935 . . . . 0.0 110.47 -179.603 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.2 t -112.86 94.2 4.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.215 -0.928 . . . . 0.0 109.975 179.475 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -51.9 -36.05 47.48 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 121.068 -1.02 . . . . 0.0 110.569 179.95 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.84 ' CD2' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -61.2 -32.07 71.83 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.184 -0.947 . . . . 0.0 110.163 179.225 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.9 m -98.74 -4.38 33.62 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.073 -1.017 . . . . 0.0 112.358 -179.864 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.57 38.71 28.81 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.33 -1.481 . . . . 0.0 110.568 -179.642 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -139.61 170.9 15.05 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 109.637 179.785 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -117.77 135.6 53.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.16 -0.963 . . . . 0.0 110.695 -179.592 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -100.82 133.36 45.42 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.174 -0.954 . . . . 0.0 109.483 179.391 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.2 t -75.87 -24.08 55.67 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.187 -0.945 . . . . 0.0 111.881 -179.392 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.836 ' HB2' HG11 ' A' ' 20' ' ' VAL . 46.8 m-70 -110.93 137.8 48.11 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.761 -1.212 . . . . 0.0 110.428 -179.842 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -125.51 85.99 2.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.671 179.659 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.04 179.69 1.3 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.268 -0.895 . . . . 0.0 109.906 -179.496 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.446 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.01 -31.7 14.57 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.329 1.173 . . . . 0.0 110.896 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.5 m -86.13 -46.57 10.31 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.876 -1.14 . . . . 0.0 109.752 179.305 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.2 t -59.54 -52.72 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.164 -0.96 . . . . 0.0 109.687 179.739 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -56.39 -52.41 64.7 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.025 -1.047 . . . . 0.0 109.634 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -60.62 -39.9 89.89 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.941 178.82 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.1 m -55.31 -43.53 74.94 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.044 -1.035 . . . . 0.0 108.313 178.272 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -62.67 -38.87 92.03 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.845 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.15 50.03 1.07 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.318 -0.864 . . . . 0.0 110.399 -179.922 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.33 37.47 3.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -0.987 . . . . 0.0 110.336 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.18 127.16 2.78 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.94 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.27 -28.65 43.24 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.123 -1.222 . . . . 0.0 110.331 179.092 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -59.18 -33.36 70.85 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 120.949 -1.094 . . . . 0.0 110.57 179.735 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.603 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.58 -39.63 50.13 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.979 -1.076 . . . . 0.0 110.803 -179.545 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -54.77 33.15 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.118 -0.988 . . . . 0.0 109.127 179.368 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.84 -39.16 88.04 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.203 -0.936 . . . . 0.0 109.052 178.693 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -56.27 -37.29 69.6 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.209 -0.932 . . . . 0.0 110.103 179.057 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.84 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.0 t -55.1 -36.24 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.062 -1.024 . . . . 0.0 110.099 179.609 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 30.9 tttt -54.75 -40.9 69.79 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.928 -1.107 . . . . 0.0 109.714 179.328 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.77 -28.02 65.54 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.372 178.975 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -72.29 -52.79 14.69 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.869 -1.145 . . . . 0.0 110.314 -179.966 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 36.8 p90 -99.28 31.12 3.2 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.11 -0.994 . . . . 0.0 111.5 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.416 ' O ' ' NE2' ' A' ' 39' ' ' GLN . 1.0 OUTLIER -72.85 -39.53 66.46 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.708 -1.245 . . . . 0.0 110.014 179.251 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -118.81 26.07 9.8 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.265 -0.897 . . . . 0.0 111.235 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 22.8 t90 -69.54 -42.49 74.57 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.962 -1.086 . . . . 0.0 110.078 -179.88 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.498 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.0 ttm -151.09 40.63 0.72 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.166 -0.959 . . . . 0.0 110.532 -179.974 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 52.57 -172.05 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.946 -1.096 . . . . 0.0 110.734 179.869 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 53.56 -172.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.102 -0.999 . . . . 0.0 110.67 -179.957 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -114.24 130.69 56.63 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.231 -0.918 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -120.19 75.29 1.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.291 -0.88 . . . . 0.0 110.114 -179.981 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.54 37.11 2.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.118 -0.989 . . . . 0.0 110.4 179.703 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.1 m -113.91 -55.34 2.51 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.153 -0.967 . . . . 0.0 109.687 179.485 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.03 -21.41 63.58 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.208 -0.933 . . . . 0.0 111.5 179.469 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.567 ' O ' HG23 ' A' ' 54' ' ' THR . 44.8 mm -67.21 -41.73 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.568 -1.332 . . . . 0.0 109.424 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.437 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 3.0 m-20 -63.91 -39.81 95.03 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 179.887 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.651 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 55.7 mttt -66.78 -36.43 82.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.148 -0.97 . . . . 0.0 110.33 179.856 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.7 m -85.46 -40.05 16.83 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.071 -1.018 . . . . 0.0 110.088 179.747 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.567 HG23 ' O ' ' A' ' 50' ' ' ILE . 21.9 p -58.55 -37.44 75.71 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.007 . . . . 0.0 110.21 179.799 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.37 -40.58 11.37 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.105 -0.997 . . . . 0.0 110.156 179.802 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.85 52.27 1.32 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.085 -1.009 . . . . 0.0 110.498 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -92.89 -57.76 2.55 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.181 -0.949 . . . . 0.0 110.242 179.672 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -153.5 40.12 0.51 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.622 -179.908 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -121.97 69.13 0.94 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.22 -0.925 . . . . 0.0 110.19 -180.0 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 109.33 109.97 3.3 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.983 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 O-C-N 121.256 -1.144 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ptm . . . . . 0 N--CA 1.498 1.954 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 77.3 1.96 Allowed 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.252 1.133 . . . . 0.0 110.349 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.1 mtmt -137.4 158.5 44.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.16 -0.962 . . . . 0.0 110.034 179.896 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.642 ' HD1' HD13 ' A' ' 13' ' ' LEU . 89.4 t80 -114.91 162.04 17.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.126 -0.984 . . . . 0.0 110.405 -179.51 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -137.25 133.05 34.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.243 -0.911 . . . . 0.0 110.01 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 t -112.2 93.21 4.34 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.118 179.475 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -52.29 -36.03 51.87 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 121.026 -1.046 . . . . 0.0 110.367 179.813 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.859 ' CD2' HG13 ' A' ' 34' ' ' VAL . 85.4 m-85 -60.28 -30.88 69.74 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.205 -0.935 . . . . 0.0 110.196 178.982 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.1 m -100.81 -2.08 33.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.012 -1.055 . . . . 0.0 112.275 -179.713 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.88 38.34 26.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.407 -1.433 . . . . 0.0 110.664 -179.653 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -140.2 168.45 19.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.213 -0.929 . . . . 0.0 109.762 179.737 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -118.34 142.59 47.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.2 -0.938 . . . . 0.0 110.619 -179.524 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.642 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.5 mp -101.37 160.64 14.25 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.211 -0.931 . . . . 0.0 109.769 179.465 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.416 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.3 t -102.51 -30.35 11.03 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.191 -0.943 . . . . 0.0 112.045 -179.286 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.617 ' O ' HG11 ' A' ' 20' ' ' VAL . 32.8 m170 -113.57 111.76 22.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.79 -1.194 . . . . 0.0 110.533 -179.597 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -92.95 67.17 4.3 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.162 -0.961 . . . . 0.0 110.468 179.837 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -107.39 178.14 1.15 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.155 -0.966 . . . . 0.0 110.009 179.684 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.39 -30.7 15.07 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.332 1.175 . . . . 0.0 111.276 -179.816 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 m -86.89 -41.13 14.24 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.86 -1.15 . . . . 0.0 110.122 179.865 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.617 HG11 ' O ' ' A' ' 15' ' ' HIS . 88.7 t -58.45 -57.04 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 O-C-N 121.073 -1.017 . . . . 0.0 109.914 179.893 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -53.69 -50.21 66.35 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.947 -1.095 . . . . 0.0 110.094 -179.824 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -62.97 -41.07 99.44 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.741 178.781 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.05 -43.35 73.72 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.234 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -63.12 -38.49 91.37 Favored 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.832 177.908 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 t -97.6 49.55 1.04 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.366 -179.894 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -117.38 37.79 3.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.06 -1.025 . . . . 0.0 110.375 179.853 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.11 127.27 2.82 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.792 -1.323 . . . . 0.0 109.792 -179.906 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -54.35 -28.59 43.92 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.151 -1.205 . . . . 0.0 110.323 179.064 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -59.36 -33.63 71.4 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.982 -1.073 . . . . 0.0 110.53 179.764 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.5 t-80 -50.5 -38.71 45.71 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.98 -1.075 . . . . 0.0 110.793 -179.477 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -62.88 -55.63 24.39 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.165 -0.96 . . . . 0.0 109.153 179.31 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -59.4 -38.56 80.89 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.232 -0.917 . . . . 0.0 109.215 178.661 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.27 -38.26 70.95 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.204 -0.935 . . . . 0.0 110.116 179.327 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.859 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.9 t -58.03 -35.25 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.578 0 O-C-N 121.027 -1.045 . . . . 0.0 110.152 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 22.1 tttt -52.59 -40.58 62.78 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 121.006 -1.059 . . . . 0.0 110.075 179.613 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -57.94 -28.2 64.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.279 -0.888 . . . . 0.0 110.532 178.971 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -71.88 -52.37 17.67 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.856 -1.153 . . . . 0.0 110.386 -179.882 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 39.8 p90 -99.49 34.1 2.3 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.033 -1.042 . . . . 0.0 111.479 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -80.35 -39.88 27.73 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.758 -1.214 . . . . 0.0 110.074 179.035 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -117.75 34.64 5.05 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.202 -0.936 . . . . 0.0 110.533 179.711 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -92.21 -48.28 6.78 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.122 -0.986 . . . . 0.0 110.539 -179.751 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 tpp -146.02 -60.83 0.32 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.146 -0.971 . . . . 0.0 110.823 -179.785 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -121.8 -175.84 3.19 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.074 -1.016 . . . . 0.0 110.607 -179.603 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -99.89 -37.14 9.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.197 -0.939 . . . . 0.0 110.976 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -104.79 78.83 1.47 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.917 -1.115 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -116.46 74.76 0.92 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.213 -0.929 . . . . 0.0 110.011 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.9 35.06 3.37 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.206 -0.933 . . . . 0.0 110.673 179.843 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 m -109.8 -54.5 2.55 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.173 -0.954 . . . . 0.0 109.254 179.084 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.72 -20.92 64.02 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.266 -0.896 . . . . 0.0 111.313 179.184 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.539 HD12 HG11 ' A' ' 34' ' ' VAL . 47.2 mm -72.72 -40.71 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 120.701 -1.249 . . . . 0.0 109.663 179.703 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.465 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 10.4 t70 -74.06 -40.76 62.57 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.196 -0.94 . . . . 0.0 109.911 179.919 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -58.33 -34.41 70.58 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.211 -0.93 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.6 m -89.93 -44.79 9.66 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.014 -1.054 . . . . 0.0 110.263 -179.942 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 22.9 p -57.4 -31.53 65.92 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.114 -0.991 . . . . 0.0 110.822 179.945 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.91 -33.71 15.5 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.803 -1.185 . . . . 0.0 111.089 -179.907 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.89 -38.53 15.55 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.913 -1.117 . . . . 0.0 110.451 -179.89 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -53.23 -36.46 61.06 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.998 -1.064 . . . . 0.0 110.691 -179.953 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -111.67 39.16 2.42 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.061 -1.025 . . . . 0.0 110.354 179.855 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -153.14 72.11 0.93 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.191 -0.943 . . . . 0.0 110.528 179.991 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.42 -94.13 0.23 Allowed Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.198 -1.177 . . . . 0.0 110.225 179.993 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.105 0 CA-C-O 119.856 -0.116 . . . . 0.0 110.778 . . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 1' ' ' MET . 49.7 Cg_endo -80.02 135.94 11.41 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 O-C-N 123.178 1.094 . . . . 0.0 110.446 -179.768 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -139.55 160.3 40.18 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.221 -0.924 . . . . 0.0 110.091 179.992 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.609 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.8 t80 -112.08 161.51 16.42 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.207 -179.931 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -136.72 132.38 34.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.237 -0.914 . . . . 0.0 110.183 -179.573 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.0 t -111.97 94.46 4.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.095 -1.003 . . . . 0.0 110.083 179.526 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.08 -35.82 48.84 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.133 -0.979 . . . . 0.0 110.538 179.901 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.883 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.1 m-85 -61.6 -33.36 73.77 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.104 -0.997 . . . . 0.0 110.001 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.3 m -96.12 -3.43 44.58 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.102 -0.999 . . . . 0.0 112.176 179.968 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 52.68 39.33 28.26 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.379 -1.451 . . . . 0.0 110.538 -179.72 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.44 172.72 12.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.942 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -118.89 139.08 52.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.281 -0.887 . . . . 0.0 110.611 -179.62 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.609 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -99.08 168.24 10.2 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.209 -0.932 . . . . 0.0 109.626 179.462 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.79 -30.47 12.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.122 -0.986 . . . . 0.0 111.6 -179.601 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 45.2 m-70 -114.85 147.73 39.5 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.892 -1.13 . . . . 0.0 110.214 -179.89 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -126.55 90.6 3.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.197 -0.939 . . . . 0.0 109.801 179.94 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.447 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.32 178.32 1.48 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.227 -0.92 . . . . 0.0 110.177 -179.708 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 41.7 Cg_endo -70.12 -31.35 19.08 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.448 1.236 . . . . 0.0 110.802 179.856 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.41 -36.97 23.84 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.056 -1.027 . . . . 0.0 110.057 179.283 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 79.4 t -72.97 -48.81 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 121.029 -1.044 . . . . 0.0 109.821 179.677 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 21.6 mtm180 -57.27 -52.26 66.06 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.072 -1.018 . . . . 0.0 109.764 179.951 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -59.17 -39.52 82.76 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.13 -0.982 . . . . 0.0 109.203 179.056 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.3 m -55.98 -43.44 77.58 Favored 'General case' 0 N--CA 1.511 2.62 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.237 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -63.04 -40.27 97.21 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.889 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.6 55.83 2.27 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.395 -0.815 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.2 37.34 4.03 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.122 -0.986 . . . . 0.0 110.371 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.6 127.3 2.69 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.932 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -28.11 47.31 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.116 -1.226 . . . . 0.0 110.344 179.138 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -60.3 -33.18 71.99 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.939 -1.101 . . . . 0.0 110.626 179.775 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.95 -37.91 34.16 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.955 -1.091 . . . . 0.0 110.781 -179.662 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -62.61 -56.41 18.1 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.086 -1.008 . . . . 0.0 109.166 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.04 -38.59 79.68 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.223 -0.923 . . . . 0.0 109.156 178.764 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -56.59 -37.86 71.21 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 110.035 179.28 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.883 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.5 t -57.99 -36.34 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.127 -0.983 . . . . 0.0 109.982 179.756 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.7 ttpm? -54.89 -42.29 71.95 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.921 -1.112 . . . . 0.0 109.611 179.488 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.08 -28.33 64.48 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.298 -0.876 . . . . 0.0 110.373 178.899 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -70.23 -52.28 24.35 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.915 -1.116 . . . . 0.0 110.292 -179.841 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.4 p90 -99.77 34.39 2.28 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.096 -1.003 . . . . 0.0 111.358 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.71 -37.28 24.95 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.714 -1.241 . . . . 0.0 110.154 178.83 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -110.32 29.43 7.69 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 179.587 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.1 t90 -90.77 -40.23 11.93 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.014 -1.054 . . . . 0.0 109.973 179.878 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -154.89 -66.46 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.199 -0.938 . . . . 0.0 110.483 179.84 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -124.26 -164.34 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.196 -0.94 . . . . 0.0 110.09 179.971 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -126.9 38.71 4.05 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.104 -0.997 . . . . 0.0 110.378 179.725 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -159.13 75.05 0.67 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.224 -0.922 . . . . 0.0 110.504 179.886 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.17 82.96 1.96 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.137 -0.977 . . . . 0.0 110.349 -179.837 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -109.34 36.08 3.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.119 -0.988 . . . . 0.0 110.33 179.617 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.5 m -115.05 -55.55 2.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.088 -1.007 . . . . 0.0 109.608 179.416 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -22.31 61.97 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.222 -0.924 . . . . 0.0 111.153 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.661 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -66.39 -39.85 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 120.646 -1.284 . . . . 0.0 109.291 179.191 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -72.35 -36.16 68.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.226 -0.921 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.709 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 68.2 mttt -76.48 -35.6 58.31 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.036 -1.04 . . . . 0.0 110.615 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -78.46 -39.85 37.31 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.053 -1.029 . . . . 0.0 110.136 179.944 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' ILE . 18.6 p -60.55 -39.56 88.38 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.138 -0.976 . . . . 0.0 110.144 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.97 -43.21 9.57 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.191 -0.943 . . . . 0.0 110.109 179.759 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.07 57.49 2.41 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.167 -0.958 . . . . 0.0 110.096 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -92.79 -39.91 10.96 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.241 -0.912 . . . . 0.0 110.247 179.86 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -114.19 48.86 1.05 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.152 -0.967 . . . . 0.0 110.247 179.991 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -130.84 -60.61 0.97 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.259 -0.9 . . . . 0.0 110.137 179.953 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 104.24 68.14 0.74 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.991 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.501 2.09 0 O-C-N 121.064 -1.256 . . . . 0.0 110.814 179.969 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.4 mtm . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.52 121.47 7.46 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.455 1.239 . . . . 0.0 110.464 -179.962 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HB2' ' OH ' ' A' ' 12' ' ' TYR . 32.4 mttm -130.74 157.88 41.63 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.963 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.579 ' HD2' HD13 ' A' ' 13' ' ' LEU . 73.9 t80 -113.1 161.86 16.61 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.082 -1.011 . . . . 0.0 110.292 -179.626 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -131.59 137.46 48.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.237 -0.914 . . . . 0.0 110.232 -179.82 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.08 97.9 6.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.145 -0.972 . . . . 0.0 109.989 179.512 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -51.93 -35.95 47.48 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.061 -1.025 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.841 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.8 m-85 -63.19 -32.26 73.61 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.091 -1.006 . . . . 0.0 110.167 179.38 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.8 m -98.2 -8.94 26.47 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.058 -1.026 . . . . 0.0 112.024 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 54.87 41.0 32.25 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.344 -1.472 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.09 173.28 11.66 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.246 -0.909 . . . . 0.0 110.025 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' OH ' ' HB2' ' A' ' 3' ' ' LYS . 5.1 t80 -120.08 131.52 55.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.577 -179.6 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.579 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.1 mp -88.84 170.45 10.72 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.143 -0.973 . . . . 0.0 109.7 179.48 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.41 HG23 ' CG ' ' A' ' 15' ' ' HIS . 15.2 t -96.93 -31.29 12.63 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.302 -0.873 . . . . 0.0 111.375 -179.83 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.724 ' HB2' HG11 ' A' ' 20' ' ' VAL . 33.3 m170 -112.24 146.75 37.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.824 -1.173 . . . . 0.0 110.125 179.916 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -126.27 93.96 3.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 109.861 179.919 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.456 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -148.63 178.47 1.45 Allowed Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.182 -0.949 . . . . 0.0 110.312 -179.533 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.46 -32.87 14.9 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.384 1.202 . . . . 0.0 110.852 179.873 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.8 m -83.99 -39.87 19.16 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.965 -1.085 . . . . 0.0 109.839 179.396 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.724 HG11 ' HB2' ' A' ' 15' ' ' HIS . 58.4 t -65.74 -47.39 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 O-C-N 121.081 -1.012 . . . . 0.0 109.642 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -57.19 -50.83 71.61 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.127 -0.983 . . . . 0.0 109.565 179.777 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -61.48 -40.96 96.46 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.22 -0.925 . . . . 0.0 108.732 178.803 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -54.19 -43.22 70.54 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.178 -0.951 . . . . 0.0 108.524 178.33 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -62.33 -37.71 86.67 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.348 -0.845 . . . . 0.0 108.853 178.076 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -96.58 51.66 1.18 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.202 -0.936 . . . . 0.0 110.317 -179.861 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m -117.1 37.64 3.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.28 128.34 3.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.919 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -28.61 45.54 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.136 -1.214 . . . . 0.0 110.351 179.172 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -59.37 -34.9 72.97 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.029 -1.044 . . . . 0.0 110.393 179.764 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.578 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.22 -39.01 55.63 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.961 -1.087 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -61.9 -55.09 33.29 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.114 179.27 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -38.84 83.6 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.217 -0.927 . . . . 0.0 109.193 178.65 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.35 -36.96 71.85 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.091 -1.005 . . . . 0.0 110.203 179.156 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.958 HG11 HD12 ' A' ' 50' ' ' ILE . 72.2 t -57.85 -35.39 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.08 -1.012 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.8 mmmt -52.65 -39.44 61.81 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.877 -1.14 . . . . 0.0 109.957 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.44 -28.82 65.64 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 178.9 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -73.28 -54.11 9.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.853 -1.154 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 31.6 p90 -98.56 31.73 2.78 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.088 -1.008 . . . . 0.0 111.508 179.88 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.88 -38.41 64.4 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.739 -1.226 . . . . 0.0 109.777 178.948 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.4 22.58 13.95 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.253 -0.904 . . . . 0.0 111.114 179.176 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.525 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.3 t90 -101.5 -49.31 4.07 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.908 -1.12 . . . . 0.0 109.804 179.662 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.525 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 28.2 mmt -111.98 -53.02 2.75 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.245 -0.91 . . . . 0.0 110.245 179.701 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 54.79 39.31 31.33 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.986 -1.071 . . . . 0.0 110.674 179.99 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -149.04 -66.29 0.23 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.179 -0.95 . . . . 0.0 110.439 179.888 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -166.89 77.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.193 -0.942 . . . . 0.0 110.851 -179.982 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.42 73.4 1.53 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.233 -0.917 . . . . 0.0 110.301 -179.799 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.09 33.62 5.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.162 -0.962 . . . . 0.0 110.524 179.445 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.1 p -107.27 -50.82 3.01 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.096 -1.002 . . . . 0.0 109.678 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.36 -21.84 60.45 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.219 -0.926 . . . . 0.0 111.527 179.369 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.958 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -76.66 -39.72 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 120.716 -1.24 . . . . 0.0 109.925 179.777 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.466 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 31.7 t0 -80.39 -40.72 25.97 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.153 -0.967 . . . . 0.0 109.958 179.758 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.749 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 24.2 ttmt -58.06 -33.24 68.82 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -0.91 . . . . 0.0 110.685 179.816 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.4 m -86.76 -41.3 14.23 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.997 -1.064 . . . . 0.0 110.109 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.613 HG23 ' O ' ' A' ' 50' ' ' ILE . 27.4 p -59.38 -37.68 78.54 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.124 -0.985 . . . . 0.0 110.134 179.897 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.48 -40.98 11.09 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.14 -0.975 . . . . 0.0 110.154 179.761 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.749 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.24 53.98 1.59 Allowed 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.151 -0.968 . . . . 0.0 110.293 179.597 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -93.25 -48.28 6.52 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.196 -0.94 . . . . 0.0 110.062 179.785 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -132.52 74.94 1.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.234 -0.916 . . . . 0.0 110.098 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -124.08 -60.08 1.45 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.106 -0.996 . . . . 0.0 110.247 -179.948 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 113.85 70.62 0.53 Allowed Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt . . . . . 0 N--CA 1.496 1.866 0 O-C-N 121.228 -1.16 . . . . 0.0 110.286 -179.946 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.47 145.91 43.44 Favored 'Trans proline' 0 C--N 1.318 -1.074 0 O-C-N 123.374 1.197 . . . . 0.0 110.334 179.952 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 34.7 mttt -147.61 144.33 28.35 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 110.561 -179.835 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.564 ' HD2' HD13 ' A' ' 13' ' ' LEU . 57.3 t80 -112.69 155.28 24.77 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.213 -0.93 . . . . 0.0 109.816 179.552 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -134.28 139.55 45.8 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.158 -0.964 . . . . 0.0 110.532 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.0 t -111.34 98.39 7.45 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.258 -0.901 . . . . 0.0 110.185 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -53.52 -35.79 61.05 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.148 -0.97 . . . . 0.0 110.462 179.72 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.85 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.1 m-85 -63.01 -33.12 74.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.105 -0.997 . . . . 0.0 110.306 179.44 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.4 m -98.75 -2.83 37.13 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.005 -1.059 . . . . 0.0 112.082 179.855 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 53.8 37.98 27.57 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.37 -1.456 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -131.32 171.66 13.08 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.168 -0.957 . . . . 0.0 109.98 179.697 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.412 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -125.06 107.64 11.01 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.905 . . . . 0.0 110.12 179.852 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.564 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.6 mp -67.31 166.74 13.74 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.167 -0.958 . . . . 0.0 109.854 -179.999 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.435 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.4 t -100.19 -30.42 11.93 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.266 -0.896 . . . . 0.0 111.628 -179.694 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.435 ' CG ' HG23 ' A' ' 14' ' ' THR . 31.3 m170 -115.85 139.76 49.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.819 -1.175 . . . . 0.0 110.184 -179.897 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -116.02 92.04 3.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.255 -0.903 . . . . 0.0 109.901 179.746 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.44 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -137.83 177.92 1.92 Allowed Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 -179.637 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.44 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.7 Cg_endo -70.32 -31.41 18.09 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.364 1.191 . . . . 0.0 110.974 179.995 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -43.78 11.72 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.972 -1.08 . . . . 0.0 109.842 179.501 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 15' ' ' HIS . 92.8 t -60.12 -49.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.636 179.842 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtp-105 -59.61 -50.85 72.26 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.038 -1.039 . . . . 0.0 109.332 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.07 -39.96 91.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.214 -0.929 . . . . 0.0 108.85 178.821 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.9 m -54.37 -42.84 70.79 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.057 -1.027 . . . . 0.0 108.611 178.32 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -62.73 -37.47 86.69 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 119.63 -0.828 . . . . 0.0 109.109 178.066 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.8 49.54 1.09 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.156 -0.965 . . . . 0.0 110.529 -179.727 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.89 40.31 2.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.096 -1.002 . . . . 0.0 109.782 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.37 148.96 19.95 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.666 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -79.64 -9.11 59.58 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.298 -1.119 . . . . 0.0 111.064 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -91.47 -21.34 20.97 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.678 -1.264 . . . . 0.0 111.449 179.657 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.9 t-80 -48.49 -37.52 17.67 Favored 'General case' 0 N--CA 1.518 2.953 0 O-C-N 120.743 -1.223 . . . . 0.0 110.968 -179.559 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -63.11 -54.26 40.71 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.092 -1.005 . . . . 0.0 108.981 179.241 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.26 -39.2 85.99 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.0 178.609 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.88 -37.37 68.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.167 -0.958 . . . . 0.0 110.103 179.218 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.85 HG13 ' CD2' ' A' ' 8' ' ' TYR . 69.4 t -56.13 -35.34 41.59 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 O-C-N 120.993 -1.067 . . . . 0.0 110.066 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.5 tptm -52.4 -39.93 61.5 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.905 -1.122 . . . . 0.0 110.056 179.562 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.67 -29.6 64.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -69.96 -53.04 19.56 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.901 -1.124 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.455 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -100.0 34.76 2.21 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.124 -0.985 . . . . 0.0 111.227 179.793 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.08 -35.86 23.44 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.744 -1.222 . . . . 0.0 110.3 178.978 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -105.17 23.23 13.99 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.043 -1.035 . . . . 0.0 111.289 179.553 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.519 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 14.9 t90 -99.76 -45.28 5.8 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.855 -1.153 . . . . 0.0 110.152 179.89 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.519 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -124.34 42.18 3.32 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.125 -0.984 . . . . 0.0 110.094 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.12 -75.46 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.294 -0.878 . . . . 0.0 110.919 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -168.97 44.36 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.775 -1.203 . . . . 0.0 111.124 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -147.47 75.38 1.36 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 179.954 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -155.93 74.57 0.86 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.25 -0.906 . . . . 0.0 110.74 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -118.43 36.62 4.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.178 -0.951 . . . . 0.0 110.518 179.676 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -113.22 -54.94 2.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.183 -0.948 . . . . 0.0 109.721 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.55 63.54 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.288 -0.883 . . . . 0.0 111.328 179.405 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.784 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -68.88 -40.93 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 120.693 -1.255 . . . . 0.0 109.464 179.597 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.75 -41.35 17.72 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.17 -0.956 . . . . 0.0 109.76 179.663 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -60.86 -32.41 71.83 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.288 -0.883 . . . . 0.0 110.457 179.676 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.564 HG22 ' CD2' ' A' ' 57' ' ' PHE . 83.3 m -88.31 -39.85 14.05 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.977 -1.077 . . . . 0.0 110.323 -179.975 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 50' ' ' ILE . 31.4 p -67.82 -39.91 83.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.106 -0.996 . . . . 0.0 109.901 179.761 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.13 -33.73 63.13 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.113 -0.992 . . . . 0.0 110.886 179.969 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -90.2 -39.51 12.76 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.065 -1.022 . . . . 0.0 110.273 179.976 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CD2' HG22 ' A' ' 53' ' ' THR . 1.8 m-85 -57.3 -38.33 73.83 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.152 -0.968 . . . . 0.0 110.25 -179.973 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -112.97 -59.44 2.02 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.057 -1.027 . . . . 0.0 110.207 179.874 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 52.52 70.38 0.58 Allowed 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.091 -1.006 . . . . 0.0 110.777 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -120.51 41.74 1.87 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.989 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.1 tttt . . . . . 0 N--CA 1.494 1.769 0 O-C-N 121.219 -1.165 . . . . 0.0 110.18 -179.964 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.0 mtm . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.92 148.19 45.12 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.347 1.182 . . . . 0.0 110.427 -179.986 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 12' ' ' TYR . 91.4 mttt -127.67 149.69 50.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.19 -0.944 . . . . 0.0 110.147 -179.994 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 13' ' ' LEU . 44.7 t80 -104.57 148.85 26.05 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.3 -0.875 . . . . 0.0 109.465 179.47 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -125.08 130.15 51.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.2 -0.938 . . . . 0.0 110.542 -179.407 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.0 t -109.98 93.87 4.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.182 -0.949 . . . . 0.0 109.686 179.375 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -51.74 -36.41 47.04 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 121.158 -0.964 . . . . 0.0 111.035 -179.427 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.882 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.053 -1.029 . . . . 0.0 110.114 179.461 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -96.42 -4.23 42.12 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.002 -1.061 . . . . 0.0 111.952 179.605 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 53.68 47.25 24.21 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.428 -1.42 . . . . 0.0 110.66 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 t -140.95 171.26 14.32 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.265 -0.897 . . . . 0.0 110.373 179.852 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE2' ' CD ' ' A' ' 3' ' ' LYS . 12.1 t80 -126.66 104.68 8.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.991 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.678 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.4 mp -65.22 163.48 15.16 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.868 -179.739 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.427 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.4 t -99.3 -31.05 11.89 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.199 -0.938 . . . . 0.0 111.591 -179.611 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.427 ' CG ' HG23 ' A' ' 14' ' ' THR . 31.1 m170 -114.23 136.42 52.98 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.823 -1.173 . . . . 0.0 110.076 180.0 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -114.31 92.09 3.84 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.155 -0.966 . . . . 0.0 109.849 179.66 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.433 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.12 179.04 1.47 Allowed Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.232 -0.918 . . . . 0.0 109.983 -179.601 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.16 -30.84 15.52 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.293 1.154 . . . . 0.0 111.028 179.994 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.1 m -89.27 -43.73 10.76 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.942 -1.099 . . . . 0.0 109.887 179.607 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.9 t -59.26 -52.48 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.58 0 O-C-N 121.121 -0.987 . . . . 0.0 109.833 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 mtp-105 -58.2 -50.08 74.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.135 -0.978 . . . . 0.0 109.511 179.817 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt -61.47 -40.06 93.16 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.291 -0.963 . . . . 0.0 108.88 178.72 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 m -54.29 -43.03 70.71 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.109 -0.994 . . . . 0.0 108.539 178.269 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -62.7 -37.91 88.34 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.96 177.961 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.92 52.09 1.15 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.178 -0.952 . . . . 0.0 110.188 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.37 38.05 3.36 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.051 -1.031 . . . . 0.0 110.392 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.78 126.47 2.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.976 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -53.95 -28.72 38.98 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.107 -1.231 . . . . 0.0 110.378 179.217 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -60.4 -31.54 70.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 0.0 110.645 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.535 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.3 t-80 -49.52 -37.97 28.86 Favored 'General case' 0 N--CA 1.516 2.832 0 O-C-N 120.933 -1.105 . . . . 0.0 110.964 -179.564 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -62.23 -54.23 43.78 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.072 -1.018 . . . . 0.0 109.118 179.3 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.38 -38.43 83.89 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.123 178.612 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -56.57 -37.65 70.87 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.274 -0.891 . . . . 0.0 110.18 179.321 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.908 HG11 HD12 ' A' ' 50' ' ' ILE . 95.1 t -59.62 -39.32 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.123 -0.986 . . . . 0.0 109.722 179.645 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 52.3 mttt -54.06 -40.91 67.59 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.016 -1.052 . . . . 0.0 109.606 179.331 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.42 -34.92 69.44 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.052 178.993 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -62.15 -52.56 63.36 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.002 -1.061 . . . . 0.0 109.602 179.649 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 49.8 p90 -100.94 38.0 1.63 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.276 -0.89 . . . . 0.0 110.781 179.412 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -87.0 -37.35 17.6 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.927 -1.108 . . . . 0.0 110.067 178.874 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.35 19.25 14.7 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.179 -0.951 . . . . 0.0 111.179 179.244 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.6 t90 -105.86 -55.98 2.25 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.809 -1.182 . . . . 0.0 109.971 179.704 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 5.1 tpp -143.14 57.98 1.4 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.864 . . . . 0.0 109.855 179.963 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.22 89.23 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.525 0 O-C-N 121.206 -0.934 . . . . 0.0 110.254 -179.69 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.08 -58.73 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.249 -0.907 . . . . 0.0 110.733 179.891 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -159.71 76.32 0.65 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.302 -0.873 . . . . 0.0 110.722 179.868 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.15 71.0 1.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.182 -0.949 . . . . 0.0 110.386 -179.816 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.67 32.81 5.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.174 -0.954 . . . . 0.0 110.657 179.406 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -104.07 -48.67 3.82 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.08 -1.012 . . . . 0.0 109.568 179.297 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -21.25 62.78 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.169 -0.957 . . . . 0.0 111.469 179.491 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.908 HD12 HG11 ' A' ' 34' ' ' VAL . 50.3 mm -82.12 -53.11 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 120.646 -1.284 . . . . 0.0 109.945 179.728 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 22.0 t0 -56.88 -39.57 74.6 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.135 -0.978 . . . . 0.0 110.32 -179.855 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 60.5 mttt -57.14 -36.57 70.87 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.148 -0.97 . . . . 0.0 110.54 -179.922 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m -91.64 -37.5 13.02 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.074 -1.016 . . . . 0.0 110.483 179.948 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 68.5 p -73.13 -34.69 66.25 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.081 -1.012 . . . . 0.0 110.538 179.972 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.26 -40.17 16.92 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.903 -1.123 . . . . 0.0 110.073 179.849 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.401 ' HB2' ' O ' ' A' ' 52' ' ' LYS . . . -56.73 -34.49 67.56 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.071 -1.018 . . . . 0.0 110.622 179.918 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -87.58 -34.67 18.46 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.029 -1.044 . . . . 0.0 110.694 179.945 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -101.5 57.11 0.84 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.99 -1.069 . . . . 0.0 110.119 179.81 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -116.59 -56.96 2.24 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.062 -1.024 . . . . 0.0 110.104 179.856 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.99 -58.49 0.51 Allowed Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.93 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.3 mttm . . . . . 0 N--CA 1.494 1.757 0 O-C-N 121.278 -1.131 . . . . 0.0 110.155 179.964 . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.52 153.62 55.03 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.417 1.22 . . . . 0.0 110.523 179.966 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 20.3 mtmt -144.64 153.29 41.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.245 -0.909 . . . . 0.0 110.36 -179.946 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 21' ' ' ARG . 40.7 t80 -113.53 154.42 27.13 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.286 -0.884 . . . . 0.0 109.609 179.564 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -126.45 133.82 51.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.053 -1.029 . . . . 0.0 110.538 -179.851 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 45.9 t -109.8 97.7 7.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.502 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -54.32 -36.57 63.89 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.094 -1.004 . . . . 0.0 110.272 179.715 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.0 m-85 -59.84 -32.37 70.61 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.185 179.082 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.426 ' CB ' HG22 ' A' ' 11' ' ' THR . 33.8 m -97.02 -1.81 44.7 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.984 -1.073 . . . . 0.0 112.098 -179.894 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.63 39.17 27.79 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.352 -1.468 . . . . 0.0 110.399 -179.589 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 9' ' ' CYS . 9.3 t -145.83 175.31 10.51 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -122.03 122.67 39.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.363 -0.835 . . . . 0.0 110.285 -179.624 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.627 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.2 mp -76.44 170.41 16.42 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.101 -0.999 . . . . 0.0 109.506 179.283 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.9 t -100.15 -29.4 12.51 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.173 -0.954 . . . . 0.0 111.799 -179.661 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.721 ' HB2' HG11 ' A' ' 20' ' ' VAL . 34.3 m170 -110.94 146.53 36.43 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.758 -1.214 . . . . 0.0 110.388 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -125.38 93.68 3.93 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.772 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.75 176.7 2.08 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.25 -0.906 . . . . 0.0 110.27 -179.611 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -69.59 -32.08 19.99 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.401 1.211 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -86.05 -39.5 16.74 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.954 -1.091 . . . . 0.0 109.973 179.5 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 15' ' ' HIS . 75.7 t -63.38 -47.39 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.208 -0.932 . . . . 0.0 109.595 179.751 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 mtt180 -58.29 -51.64 68.94 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.082 -1.011 . . . . 0.0 109.632 179.941 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -62.29 -41.13 98.24 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.789 179.012 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.8 m -55.68 -43.17 76.11 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.074 -1.016 . . . . 0.0 108.522 178.324 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.627 ' ND1' HD21 ' A' ' 13' ' ' LEU . 72.3 t60 -61.83 -35.35 77.98 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.644 -0.823 . . . . 0.0 109.288 178.02 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -98.92 44.42 1.03 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.051 -1.03 . . . . 0.0 110.651 -179.795 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m -116.76 39.75 3.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.117 -0.989 . . . . 0.0 109.749 179.626 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.38 163.54 21.88 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -179.667 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -89.18 -11.72 42.97 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.281 -1.129 . . . . 0.0 110.842 178.689 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.69 -26.18 19.69 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.729 -1.232 . . . . 0.0 111.087 179.659 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.717 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.1 t-80 -50.67 -39.58 51.37 Favored 'General case' 0 N--CA 1.516 2.858 0 O-C-N 120.737 -1.227 . . . . 0.0 110.546 -179.577 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -64.13 -54.37 34.83 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.945 179.17 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -60.81 -39.53 89.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.116 178.588 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.2 -38.04 73.09 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.261 -0.899 . . . . 0.0 109.988 179.194 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.728 HG11 HD12 ' A' ' 50' ' ' ILE . 78.9 t -56.81 -37.76 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 121.036 -1.04 . . . . 0.0 109.964 179.703 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.5 ttpp -54.87 -41.24 70.6 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.966 -1.084 . . . . 0.0 109.716 179.435 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.64 -32.0 68.66 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.868 . . . . 0.0 110.15 178.963 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -67.66 -52.29 39.74 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.093 -1.004 . . . . 0.0 110.158 179.899 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.64 ' HE1' HG12 ' A' ' 34' ' ' VAL . 44.2 p90 -100.22 33.12 2.75 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.12 -0.987 . . . . 0.0 111.33 179.622 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -79.49 -36.89 37.97 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.755 -1.216 . . . . 0.0 110.144 179.026 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -112.78 31.41 6.4 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.172 -0.955 . . . . 0.0 110.984 179.833 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.5 t90 -84.33 -38.94 19.75 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.085 -1.01 . . . . 0.0 110.219 179.925 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.446 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -153.72 -65.26 0.15 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.121 -0.987 . . . . 0.0 110.674 179.983 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.4 -164.64 1.51 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.19 -0.944 . . . . 0.0 110.15 -179.736 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -112.58 39.01 2.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.191 -0.943 . . . . 0.0 110.303 179.877 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -151.17 73.73 1.11 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.167 -0.958 . . . . 0.0 110.43 179.874 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.11 70.64 1.37 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.219 -0.926 . . . . 0.0 110.217 -179.945 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.85 34.56 4.75 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.224 -0.922 . . . . 0.0 110.516 179.646 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.4 m -107.28 -53.05 2.67 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.152 -0.967 . . . . 0.0 109.243 179.184 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.04 -21.37 63.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.244 -0.91 . . . . 0.0 111.225 179.203 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.728 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.56 -54.87 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.604 -1.31 . . . . 0.0 109.534 179.603 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 23.0 t70 -60.61 -40.97 93.8 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.798 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 25.9 mmtt -58.69 -35.82 73.24 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.175 -0.953 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -84.85 -36.04 21.84 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.995 -1.065 . . . . 0.0 110.308 179.717 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.8 p -74.76 -35.39 62.58 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.046 -1.034 . . . . 0.0 110.559 179.812 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.02 -39.51 12.16 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.046 -1.033 . . . . 0.0 110.295 179.953 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.799 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.83 54.65 1.76 Allowed 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.122 -0.986 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -92.85 -39.52 11.14 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.154 -0.967 . . . . 0.0 110.086 179.586 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -134.04 77.11 1.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.165 -0.959 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.03 -63.13 1.5 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.118 -0.989 . . . . 0.0 110.234 179.906 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 138.84 109.54 0.87 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.86 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.14 -1.212 . . . . 0.0 110.175 179.889 . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mtt . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.72 144.65 39.79 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.399 1.21 . . . . 0.0 110.217 179.875 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.461 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 16.2 mtmm 55.39 99.52 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.07 -1.019 . . . . 0.0 110.374 -179.859 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.462 ' CD1' HD13 ' A' ' 13' ' ' LEU . 63.7 t80 -54.0 159.16 1.86 Allowed 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.083 -1.01 . . . . 0.0 111.049 -179.493 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -141.71 130.91 23.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.887 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.5 t -113.39 92.36 3.97 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.095 -1.003 . . . . 0.0 110.449 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -53.57 -35.69 61.07 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.024 -1.048 . . . . 0.0 110.233 179.482 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 34' ' ' VAL . 86.0 m-85 -59.75 -35.42 74.54 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.134 -0.979 . . . . 0.0 109.975 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.3 m -93.54 1.08 56.85 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.186 -0.946 . . . . 0.0 112.075 179.971 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.1 38.34 23.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.453 -1.404 . . . . 0.0 110.749 -179.843 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -141.17 168.42 19.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.203 -0.936 . . . . 0.0 110.147 179.908 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 33.0 t80 -122.84 133.0 54.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.302 -0.874 . . . . 0.0 110.307 -179.739 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 13' ' ' LEU . 6.1 mp -89.23 163.85 15.22 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.11 -0.994 . . . . 0.0 109.721 179.591 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -99.56 -30.81 11.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.081 -1.012 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 44.1 m-70 -114.85 136.1 53.46 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.79 -1.194 . . . . 0.0 110.231 -179.858 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -112.92 92.85 4.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.219 -0.926 . . . . 0.0 109.826 179.75 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.85 178.77 1.51 Allowed Pre-proline 0 N--CA 1.494 1.732 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.715 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.62 -29.58 19.54 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 O-C-N 123.377 1.199 . . . . 0.0 111.137 -179.91 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -88.91 -43.56 11.09 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.948 -1.095 . . . . 0.0 109.936 179.538 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -59.83 -52.65 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.762 179.756 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.433 ' HG2' ' CG ' ' A' ' 4' ' ' PHE . 31.2 mtp-105 -58.03 -49.9 75.27 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.122 -0.986 . . . . 0.0 109.546 179.784 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -61.54 -40.35 94.35 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.841 178.689 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.1 m -54.25 -42.71 70.21 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.105 -0.997 . . . . 0.0 108.639 178.407 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -63.14 -38.65 92.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.606 -0.838 . . . . 0.0 109.075 178.198 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -95.2 53.4 1.52 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.221 -0.924 . . . . 0.0 110.457 -179.702 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.79 40.28 2.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.168 -0.957 . . . . 0.0 109.782 179.618 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.21 147.41 19.19 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 -179.74 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -79.93 -10.36 59.77 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.224 -1.163 . . . . 0.0 111.047 178.864 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -90.54 -19.36 23.86 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.632 -1.293 . . . . 0.0 111.467 179.657 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.6 t-80 -48.63 -40.32 27.26 Favored 'General case' 0 N--CA 1.517 2.925 0 O-C-N 120.681 -1.262 . . . . 0.0 110.907 -179.758 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.15 -52.81 57.25 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.743 179.118 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.29 -38.93 88.56 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.235 -0.915 . . . . 0.0 108.987 178.452 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -55.43 -37.79 68.14 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 8' ' ' TYR . 60.9 t -57.87 -37.49 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.139 -0.976 . . . . 0.0 109.788 179.576 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 27.3 tttt -54.42 -41.11 68.96 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.874 -1.141 . . . . 0.0 109.763 179.38 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.5 -27.95 64.94 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.366 178.961 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -71.35 -53.02 15.56 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.897 -1.127 . . . . 0.0 110.089 179.983 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.85 33.68 2.49 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.151 -0.968 . . . . 0.0 111.256 179.624 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -81.67 -37.25 27.73 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.767 -1.208 . . . . 0.0 110.145 179.027 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -100.06 20.92 13.58 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.195 -0.941 . . . . 0.0 111.212 179.332 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.623 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 15.0 t90 -102.6 -48.62 4.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.837 -1.165 . . . . 0.0 109.951 179.77 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.623 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -124.98 -58.13 1.48 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.24 -0.912 . . . . 0.0 109.997 179.725 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 54.0 38.73 29.51 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.922 -1.111 . . . . 0.0 110.822 179.998 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -145.87 -61.38 0.33 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.169 -0.957 . . . . 0.0 110.156 179.863 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -151.24 74.91 1.16 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.158 -0.964 . . . . 0.0 110.459 179.845 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.25 71.36 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.193 -0.942 . . . . 0.0 110.469 -179.824 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -123.32 32.33 5.69 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.223 -0.923 . . . . 0.0 110.689 179.364 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.02 -48.25 3.94 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.082 -1.011 . . . . 0.0 109.687 179.271 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -21.23 62.33 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.197 -0.94 . . . . 0.0 111.492 179.342 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.716 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -80.85 -40.2 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.666 -1.272 . . . . 0.0 110.001 179.861 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.443 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 2.0 t70 -80.43 -40.98 25.32 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.194 -0.941 . . . . 0.0 109.897 179.791 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -33.27 69.34 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.21 -0.931 . . . . 0.0 110.558 179.751 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.7 m -90.38 -38.32 13.4 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.944 -1.097 . . . . 0.0 110.489 -179.982 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 50' ' ' ILE . 33.8 p -69.31 -37.35 77.74 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.087 -1.008 . . . . 0.0 110.379 179.856 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.51 -40.62 63.92 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.043 -1.036 . . . . 0.0 110.015 179.982 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.43 50.54 1.15 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.126 -0.984 . . . . 0.0 110.596 179.606 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -93.15 -39.23 11.15 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.15 -0.969 . . . . 0.0 110.328 179.828 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.79 -59.69 1.96 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.207 -0.933 . . . . 0.0 110.356 -179.859 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -136.67 -59.0 0.73 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.197 -0.94 . . . . 0.0 110.43 -179.848 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 61.31 83.25 0.06 OUTLIER Glycine 0 N--CA 1.495 2.612 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.943 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.7 ttpp . . . . . 0 N--CA 1.494 1.747 0 O-C-N 121.214 -1.168 . . . . 0.0 110.231 -179.983 . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.61 122.84 8.58 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.417 1.219 . . . . 0.0 110.399 179.969 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 15.8 mmtt -124.19 162.05 24.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.196 -0.94 . . . . 0.0 110.054 -179.956 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.488 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.0 t80 -114.57 161.89 17.46 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.992 179.689 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -142.78 131.34 22.45 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.251 -0.906 . . . . 0.0 110.223 -179.457 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.7 t -108.08 92.25 3.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.132 -0.98 . . . . 0.0 110.012 179.339 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -51.44 -35.54 39.95 Favored 'General case' 0 N--CA 1.515 2.824 0 O-C-N 121.151 -0.968 . . . . 0.0 110.539 -179.989 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.888 ' CD2' HG13 ' A' ' 34' ' ' VAL . 79.6 m-85 -61.62 -31.04 71.1 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.059 -1.025 . . . . 0.0 110.144 179.068 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.4 m -100.8 -4.21 28.43 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.936 -1.102 . . . . 0.0 112.334 -179.856 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 t70 54.21 38.68 29.73 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.347 -1.471 . . . . 0.0 110.453 -179.614 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -137.03 169.78 17.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.218 -0.926 . . . . 0.0 109.745 179.785 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 13.9 t80 -119.34 139.54 51.8 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.207 -0.933 . . . . 0.0 110.641 -179.549 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.488 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -104.01 155.83 18.35 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.287 -0.883 . . . . 0.0 109.471 179.396 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.403 ' HA ' ' CD ' ' A' ' 3' ' ' LYS . 13.4 t -103.56 -29.43 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.076 -1.015 . . . . 0.0 112.293 -179.122 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.506 ' CB ' HG21 ' A' ' 20' ' ' VAL . 34.7 m170 -109.62 86.53 2.31 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.778 -1.201 . . . . 0.0 110.481 -179.734 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -73.78 71.08 1.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.24 -0.913 . . . . 0.0 110.169 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -114.45 179.77 0.73 Allowed Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 109.934 179.965 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.7 -31.35 13.32 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.292 1.154 . . . . 0.0 111.067 -179.915 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.5 m -85.53 -46.49 10.79 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.943 -1.098 . . . . 0.0 109.832 179.58 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' A' ' 15' ' ' HIS . 84.6 t -59.06 -52.26 62.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.089 -1.007 . . . . 0.0 109.719 179.802 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 3.1 mtt180 -56.7 -51.44 68.8 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.097 -1.002 . . . . 0.0 109.696 179.842 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -61.6 -40.49 95.0 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.766 178.816 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -55.16 -43.43 74.27 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.056 -1.027 . . . . 0.0 108.408 178.273 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.029 178.052 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -97.8 47.53 1.01 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.241 -0.912 . . . . 0.0 110.513 -179.697 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -116.21 40.23 2.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.139 -0.976 . . . . 0.0 109.815 179.493 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.11 150.36 20.16 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -179.705 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -81.14 -10.04 59.71 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.232 -1.157 . . . . 0.0 111.031 178.844 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mttp -90.46 -21.55 21.82 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.7 -1.25 . . . . 0.0 111.408 179.602 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.2 t-80 -48.33 -37.55 16.85 Favored 'General case' 0 N--CA 1.518 2.97 0 O-C-N 120.806 -1.184 . . . . 0.0 110.998 -179.735 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -63.79 -54.44 35.08 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -60.4 -39.47 87.45 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.273 -0.892 . . . . 0.0 108.968 178.748 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -55.68 -37.41 68.29 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.224 -0.923 . . . . 0.0 110.11 179.158 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.888 HG13 ' CD2' ' A' ' 8' ' ' TYR . 53.0 t -55.67 -35.34 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.015 -1.053 . . . . 0.0 110.222 179.74 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 62.8 tttt -53.1 -41.33 64.85 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.876 -1.14 . . . . 0.0 110.025 179.659 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.67 -28.91 66.18 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.296 -0.877 . . . . 0.0 110.382 178.952 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -68.45 -51.75 40.22 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 120.895 -1.128 . . . . 0.0 110.368 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.1 p90 -100.07 35.55 2.04 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.016 -1.053 . . . . 0.0 111.196 179.753 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -39.23 12.94 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.88 -1.138 . . . . 0.0 109.843 178.72 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -111.65 31.01 6.47 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.297 -0.877 . . . . 0.0 110.639 179.378 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.43 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.3 t90 -94.62 -40.26 9.92 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.082 -1.011 . . . . 0.0 110.152 -179.901 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.43 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -148.47 -63.89 0.25 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 179.954 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -146.79 -164.56 2.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.119 -0.988 . . . . 0.0 110.199 -179.908 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -111.39 39.76 2.24 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.137 -0.977 . . . . 0.0 110.143 179.884 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -144.54 74.45 1.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.233 -0.917 . . . . 0.0 110.216 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.44 71.81 1.3 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.194 -0.941 . . . . 0.0 110.355 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -114.7 35.02 4.45 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.22 -0.925 . . . . 0.0 110.493 179.663 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.2 p -108.37 -53.12 2.67 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.084 -1.01 . . . . 0.0 109.419 179.315 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -20.68 63.98 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.154 -0.966 . . . . 0.0 111.35 179.39 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.792 HD12 HG11 ' A' ' 34' ' ' VAL . 49.6 mm -74.82 -44.08 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.557 -1.339 . . . . 0.0 109.685 179.791 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.84 -41.46 95.86 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.193 -0.942 . . . . 0.0 109.826 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -59.8 -36.22 76.31 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.262 179.872 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 m -87.65 -36.96 17.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.058 -1.026 . . . . 0.0 110.329 179.743 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.49 HG23 ' O ' ' A' ' 50' ' ' ILE . 82.7 p -75.31 -40.33 58.62 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.062 -1.024 . . . . 0.0 109.882 179.729 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.99 -34.44 56.09 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.023 -1.048 . . . . 0.0 110.88 179.901 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.72 -35.91 20.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.06 -1.025 . . . . 0.0 110.419 179.865 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -92.14 11.61 24.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.999 -1.063 . . . . 0.0 111.978 179.703 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -131.38 76.28 1.71 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.614 -1.303 . . . . 0.0 110.076 179.797 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -113.27 50.76 0.87 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.167 -0.958 . . . . 0.0 110.226 179.99 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.96 -74.3 1.27 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.949 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttm . . . . . 0 N--CA 1.494 1.739 0 O-C-N 121.154 -1.204 . . . . 0.0 110.267 179.995 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mtt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.92 162.28 41.45 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 O-C-N 123.416 1.219 . . . . 0.0 110.385 -179.979 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.9 mttm 55.77 169.88 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.311 -0.868 . . . . 0.0 110.78 -179.983 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.598 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.4 t80 -130.51 162.28 29.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.048 -1.033 . . . . 0.0 110.013 -179.683 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 33.4 t80 -135.52 132.65 37.55 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.177 -0.952 . . . . 0.0 110.532 -179.583 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.7 t -110.65 90.09 3.23 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.214 -0.929 . . . . 0.0 109.633 179.248 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -50.06 -34.92 23.17 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.131 -0.981 . . . . 0.0 111.197 -179.603 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.927 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.2 m-85 -64.17 -32.24 73.74 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.848 179.526 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 43.7 m -95.98 -6.36 39.08 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.971 -1.081 . . . . 0.0 112.041 179.696 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 t70 55.81 39.68 30.71 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.447 -1.408 . . . . 0.0 110.352 -179.456 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -140.24 169.68 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 109.79 179.82 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -120.55 144.56 48.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.148 -0.97 . . . . 0.0 110.563 -179.685 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.598 HD13 ' HD1' ' A' ' 4' ' ' PHE . 6.4 mp -102.97 166.42 10.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.16 -0.962 . . . . 0.0 109.771 179.543 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.404 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.0 t -104.41 -29.96 10.38 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.103 -0.998 . . . . 0.0 112.285 -179.17 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.74 ' O ' HG11 ' A' ' 20' ' ' VAL . 33.4 m170 -112.68 124.19 52.0 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.7 -1.25 . . . . 0.0 110.451 -179.577 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -98.69 64.95 1.53 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.107 -0.996 . . . . 0.0 110.408 179.907 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.78 178.36 0.98 Allowed Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.214 -0.929 . . . . 0.0 109.96 179.825 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.07 -35.94 6.44 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.359 1.189 . . . . 0.0 110.736 -179.939 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.3 t -76.23 -39.54 54.27 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.063 -1.023 . . . . 0.0 110.011 179.711 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.74 HG11 ' O ' ' A' ' 15' ' ' HIS . 98.6 t -58.94 -54.53 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.112 -0.993 . . . . 0.0 109.856 179.923 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -55.37 -50.85 68.63 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.054 -1.029 . . . . 0.0 109.793 179.946 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -62.0 -40.85 97.06 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.797 178.77 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.3 m -56.43 -44.17 80.16 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.082 -1.011 . . . . 0.0 108.318 178.324 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -63.21 -38.29 90.6 Favored 'General case' 0 N--CA 1.503 2.192 0 C-N-CA 119.66 -0.816 . . . . 0.0 108.869 178.11 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.9 t -94.34 55.1 1.95 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.307 -0.871 . . . . 0.0 110.206 -179.988 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -114.85 39.84 2.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 110.005 179.759 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -138.52 152.14 21.89 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -81.22 -11.96 59.27 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.238 -1.154 . . . . 0.0 111.183 179.053 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -90.99 -20.92 21.59 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.694 -1.254 . . . . 0.0 111.456 179.704 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.7 t-80 -49.0 -42.39 37.73 Favored 'General case' 0 N--CA 1.518 2.929 0 O-C-N 120.715 -1.24 . . . . 0.0 111.007 -179.627 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 mtmt -62.52 -55.05 31.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.129 -0.982 . . . . 0.0 109.019 179.356 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -38.48 83.03 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.15 178.612 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.08 -39.65 75.39 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.274 -0.891 . . . . 0.0 109.935 179.359 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.927 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.9 t -62.71 -36.2 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.174 -0.954 . . . . 0.0 109.823 179.476 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.2 ttpp -52.33 -39.86 61.2 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 120.998 -1.064 . . . . 0.0 110.079 179.444 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.64 -32.13 68.77 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.195 178.985 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -66.65 -52.42 45.12 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.86 -1.15 . . . . 0.0 110.144 179.933 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.1 33.59 2.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.087 -1.008 . . . . 0.0 111.297 179.592 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -36.41 39.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.783 -1.198 . . . . 0.0 110.163 179.006 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -111.13 30.05 7.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.16 -0.963 . . . . 0.0 110.969 179.701 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 26.2 t90 -92.53 -39.79 11.17 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.119 -0.988 . . . . 0.0 110.124 179.888 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.6 tpp -143.65 -59.95 0.4 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.115 -0.991 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -151.99 -170.32 3.61 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.211 -0.93 . . . . 0.0 110.392 -179.803 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -106.29 52.77 0.72 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.1 -1.0 . . . . 0.0 110.157 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -166.36 73.47 0.16 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.187 -0.945 . . . . 0.0 110.775 179.962 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -146.14 72.07 1.28 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.266 -0.897 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -110.93 36.08 3.28 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.238 -0.914 . . . . 0.0 110.32 179.573 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -110.4 -54.07 2.62 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.151 -0.968 . . . . 0.0 109.617 179.436 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.87 -21.41 63.25 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.244 -0.91 . . . . 0.0 111.458 179.508 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 46.7 mm -70.5 -40.86 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.569 -1.332 . . . . 0.0 109.672 179.651 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -34.83 79.31 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.147 -0.971 . . . . 0.0 110.474 179.838 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -90.08 -39.36 12.94 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.034 -1.041 . . . . 0.0 110.403 179.895 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.3 m -64.87 -39.07 92.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.13 -0.981 . . . . 0.0 110.005 179.897 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.541 HG23 ' O ' ' A' ' 50' ' ' ILE . 16.7 p -56.93 -38.15 72.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.064 -1.023 . . . . 0.0 110.46 179.964 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.15 -40.4 11.04 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.13 -0.981 . . . . 0.0 110.222 179.849 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.65 52.93 1.39 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 179.74 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -92.74 -44.41 8.55 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.246 -0.909 . . . . 0.0 110.118 179.686 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -117.64 -64.39 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.201 -0.937 . . . . 0.0 110.184 -179.999 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -138.56 78.89 1.7 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.192 179.964 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.0 -76.47 1.34 Allowed Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.987 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.21 -1.171 . . . . 0.0 110.139 -179.93 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 mmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.86 166.61 29.51 Favored 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.403 1.212 . . . . 0.0 110.377 -179.913 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.447 ' HB2' ' CZ ' ' A' ' 12' ' ' TYR . 46.9 mttt -131.66 157.73 42.94 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.228 -0.92 . . . . 0.0 110.197 179.969 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.656 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.0 t80 -112.4 161.9 16.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.9 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -131.28 138.28 49.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.165 -0.96 . . . . 0.0 110.401 -179.719 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.5 t -116.83 96.95 5.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.156 -0.965 . . . . 0.0 109.955 179.46 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -51.53 -35.63 41.47 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.014 -1.054 . . . . 0.0 110.658 -179.991 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.669 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.8 m-85 -63.14 -31.07 72.12 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.132 -0.98 . . . . 0.0 110.202 179.252 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 51.7 m -100.07 -10.14 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.972 -1.08 . . . . 0.0 112.055 -179.939 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t0 56.39 40.76 29.6 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.405 -1.434 . . . . 0.0 110.167 -179.464 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -141.76 172.49 12.61 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.221 -0.924 . . . . 0.0 109.985 179.944 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.447 ' CZ ' ' HB2' ' A' ' 3' ' ' LYS . 5.0 t80 -119.96 135.1 55.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.17 -0.956 . . . . 0.0 110.575 -179.72 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.656 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.7 mp -91.48 170.28 10.08 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.234 -0.916 . . . . 0.0 109.687 179.537 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.451 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.7 t -97.58 -31.68 12.19 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.175 -0.953 . . . . 0.0 111.388 -179.717 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.451 ' CG ' HG23 ' A' ' 14' ' ' THR . 30.6 m170 -116.05 135.86 53.56 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.849 -1.157 . . . . 0.0 110.125 179.989 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.01 95.85 5.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.149 -0.969 . . . . 0.0 109.882 179.822 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.73 177.74 1.68 Allowed Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.905 . . . . 0.0 110.247 -179.603 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.5 -32.15 16.01 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.398 1.209 . . . . 0.0 110.969 179.824 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 26.8 m -85.11 -40.26 16.97 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.933 -1.105 . . . . 0.0 109.979 179.562 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -63.18 -49.52 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.135 -0.978 . . . . 0.0 109.688 179.793 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.6 mtm-85 -55.93 -52.14 65.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.061 -1.024 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -61.15 -40.28 93.26 Favored 'General case' 0 N--CA 1.509 2.48 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.883 178.811 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.9 m -55.49 -43.44 75.61 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.085 -1.009 . . . . 0.0 108.368 178.345 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -62.17 -38.8 90.42 Favored 'General case' 0 N--CA 1.504 2.227 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 177.974 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.5 t -95.83 52.34 1.32 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.218 -0.926 . . . . 0.0 110.373 -179.89 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -120.0 37.36 4.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.094 -1.003 . . . . 0.0 110.256 179.775 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.07 128.53 3.45 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.948 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -54.03 -28.89 41.2 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.168 -1.195 . . . . 0.0 110.423 179.199 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -59.75 -35.39 74.49 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.958 -1.089 . . . . 0.0 110.352 179.906 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.3 t-80 -51.25 -38.98 55.66 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.925 -1.11 . . . . 0.0 110.61 -179.611 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -62.18 -55.42 28.8 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.164 -0.96 . . . . 0.0 109.131 179.381 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -59.36 -39.45 83.32 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.249 -0.907 . . . . 0.0 109.124 178.766 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -56.44 -38.39 71.55 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.317 -0.864 . . . . 0.0 109.97 179.252 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.791 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -58.92 -37.11 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.15 -0.969 . . . . 0.0 109.952 179.743 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 31.2 mtmt -53.37 -41.46 65.87 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.969 -1.082 . . . . 0.0 109.863 179.768 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -58.38 -32.37 68.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.311 -0.868 . . . . 0.0 110.152 178.891 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -63.48 -51.31 66.13 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.027 -1.046 . . . . 0.0 110.151 179.935 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.585 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.7 p90 -100.66 36.27 1.96 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.09 -1.006 . . . . 0.0 111.151 179.62 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.15 -37.79 14.78 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.882 -1.137 . . . . 0.0 110.131 178.887 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.96 27.96 9.07 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.194 -0.941 . . . . 0.0 111.014 179.568 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.0 t90 -92.81 -40.49 10.62 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.989 -1.069 . . . . 0.0 110.198 179.921 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.435 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -149.18 -63.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.097 -1.002 . . . . 0.0 110.502 179.954 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.54 2.18 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.207 -0.933 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -109.8 39.42 2.13 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -0.98 . . . . 0.0 110.259 179.787 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -148.45 75.69 1.33 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.157 -0.964 . . . . 0.0 110.299 179.885 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.9 74.67 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.294 -0.879 . . . . 0.0 110.251 -179.836 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.91 35.01 3.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.173 -0.955 . . . . 0.0 110.46 179.611 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.3 p -109.16 -54.75 2.5 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.084 -1.01 . . . . 0.0 109.189 179.152 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -20.51 65.0 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.283 -0.885 . . . . 0.0 111.175 179.154 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.791 HD12 HG11 ' A' ' 34' ' ' VAL . 49.7 mm -75.24 -40.22 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.67 -1.269 . . . . 0.0 109.837 179.778 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.418 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.8 OUTLIER -70.57 -40.42 73.33 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.175 -0.953 . . . . 0.0 109.957 179.942 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.747 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 13.7 tttp -58.2 -35.66 71.97 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.252 -0.905 . . . . 0.0 110.488 179.967 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.0 m -90.7 -48.08 7.27 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.091 -1.006 . . . . 0.0 110.155 179.848 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 50' ' ' ILE . 64.4 p -57.38 -34.73 69.16 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.206 -0.934 . . . . 0.0 110.553 179.91 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.36 -40.13 12.27 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.035 -1.041 . . . . 0.0 110.107 179.734 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.747 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.13 48.36 1.05 Allowed 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.13 -0.981 . . . . 0.0 110.629 179.617 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.63 -42.86 9.41 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.074 -1.016 . . . . 0.0 110.258 179.724 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -131.86 74.8 1.61 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.177 -0.952 . . . . 0.0 110.499 179.946 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -113.82 -55.92 2.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.134 -0.979 . . . . 0.0 110.214 179.794 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 116.62 -56.01 0.54 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.898 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.5 mttp . . . . . 0 N--CA 1.494 1.758 0 O-C-N 121.219 -1.165 . . . . 0.0 110.181 179.987 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mtm . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.59 151.83 53.09 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.474 1.249 . . . . 0.0 110.368 179.992 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -125.49 155.41 40.57 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.234 -0.916 . . . . 0.0 110.037 -179.884 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.595 ' HD2' HD13 ' A' ' 13' ' ' LEU . 87.1 t80 -113.31 161.77 16.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.065 -1.022 . . . . 0.0 109.998 179.93 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -137.76 133.66 34.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.272 -0.892 . . . . 0.0 110.278 -179.687 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 t -114.45 98.18 6.75 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.201 -0.937 . . . . 0.0 109.718 179.382 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -56.32 -36.96 69.31 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.101 -0.999 . . . . 0.0 110.758 -179.434 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.966 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -61.93 -32.66 73.08 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.953 -1.092 . . . . 0.0 110.169 179.555 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.8 m -93.31 -6.15 48.07 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.95 -1.094 . . . . 0.0 111.897 179.456 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.71 39.48 31.34 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.443 -1.41 . . . . 0.0 110.437 -179.688 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -142.12 168.08 20.59 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.253 -0.905 . . . . 0.0 109.895 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -118.23 139.99 50.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.571 -179.706 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.595 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.9 mp -97.62 166.3 11.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.24 -0.912 . . . . 0.0 109.657 179.565 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.511 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.91 -30.63 11.55 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.128 -0.983 . . . . 0.0 111.881 -179.452 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.511 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.9 m-70 -118.11 134.98 54.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.799 -1.188 . . . . 0.0 110.226 -179.871 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -112.3 96.73 6.18 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.198 -0.939 . . . . 0.0 109.818 179.685 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -142.52 177.9 1.69 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 -179.568 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -69.87 -29.95 22.54 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.416 1.219 . . . . 0.0 111.039 179.827 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 t -88.72 -44.04 10.85 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.927 -1.108 . . . . 0.0 109.867 179.396 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.405 HG11 ' O ' ' A' ' 15' ' ' HIS . 89.7 t -61.2 -48.96 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.562 0 O-C-N 121.196 -0.94 . . . . 0.0 109.468 179.574 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -59.15 -50.65 73.22 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 109.25 179.541 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -61.7 -40.37 94.79 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.2 -0.937 . . . . 0.0 108.788 178.7 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 88.2 m -54.66 -43.57 72.52 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.042 -1.036 . . . . 0.0 108.455 178.292 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -63.38 -40.36 97.04 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.949 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -94.36 55.7 2.03 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.29 -0.881 . . . . 0.0 110.097 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.95 37.5 3.63 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.18 -0.95 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.08 125.62 2.14 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -179.952 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ttp85 -54.28 -28.34 41.32 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.207 -1.172 . . . . 0.0 110.436 179.157 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -61.22 -31.57 71.35 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.949 -1.094 . . . . 0.0 110.626 179.882 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.8 t-80 -49.35 -38.82 29.54 Favored 'General case' 0 N--CA 1.515 2.782 0 O-C-N 120.903 -1.123 . . . . 0.0 110.937 -179.503 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -63.73 -55.2 25.02 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.101 -1.0 . . . . 0.0 109.039 179.339 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -60.33 -38.99 85.46 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.136 178.682 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -57.16 -36.81 71.22 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.215 -0.928 . . . . 0.0 110.222 179.27 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.966 HG13 ' CD1' ' A' ' 8' ' ' TYR . 97.3 t -58.04 -38.69 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.069 -1.019 . . . . 0.0 109.908 179.898 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 11.3 mttt -58.59 -42.09 87.3 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.009 -1.057 . . . . 0.0 109.454 179.227 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -59.48 -31.15 69.08 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.035 178.805 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 51.2 t80 -67.36 -51.54 50.92 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.012 -1.055 . . . . 0.0 110.346 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.714 ' HE1' HG12 ' A' ' 34' ' ' VAL . 42.4 p90 -99.25 29.84 3.76 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.036 -1.04 . . . . 0.0 111.695 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -78.37 -39.75 38.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.652 -1.28 . . . . 0.0 109.732 178.666 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -115.36 36.87 3.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 179.41 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.9 t90 -92.26 -38.5 12.05 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.175 -0.953 . . . . 0.0 110.19 -179.771 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -147.11 -65.51 0.27 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.16 -0.962 . . . . 0.0 110.347 179.89 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.89 -163.11 1.66 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.205 -0.934 . . . . 0.0 110.152 -179.878 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -103.66 -177.5 3.39 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.104 -0.998 . . . . 0.0 110.073 179.791 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 53.28 74.54 0.3 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.025 -1.047 . . . . 0.0 110.608 -179.743 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.41 70.15 1.42 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.247 -0.908 . . . . 0.0 110.166 -179.967 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.64 33.61 5.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.254 -0.904 . . . . 0.0 110.629 179.595 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.96 -53.04 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.022 -1.049 . . . . 0.0 109.009 179.032 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.8 -20.54 65.12 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.331 -0.855 . . . . 0.0 111.181 178.943 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.722 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -81.53 -55.52 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 120.724 -1.235 . . . . 0.0 109.803 179.714 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.459 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 4.1 t0 -54.64 -38.97 67.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.552 -179.833 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.93 -36.69 82.12 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 179.975 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.0 m -91.4 -42.73 10.16 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.026 -1.046 . . . . 0.0 110.379 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.459 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.8 p -59.94 -40.16 88.02 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.104 -0.998 . . . . 0.0 109.994 179.999 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.57 -37.39 78.34 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.147 -0.971 . . . . 0.0 110.245 179.783 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.81 -32.64 65.68 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.136 -0.978 . . . . 0.0 110.76 179.867 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -88.85 -39.23 13.99 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.948 -1.095 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.18 -46.32 77.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.151 -0.968 . . . . 0.0 109.963 179.923 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -142.72 77.71 1.58 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.895 . . . . 0.0 110.19 179.922 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.48 -60.19 6.93 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.908 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt . . . . . 0 N--CA 1.494 1.734 0 O-C-N 121.219 -1.165 . . . . 0.0 110.235 -179.965 . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.409 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 22.4 mttt . . . . . 0 N--CA 1.504 2.267 0 CA-C-O 121.145 0.497 . . . . 0.0 110.926 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.57 ' HD2' HD13 ' A' ' 13' ' ' LEU . 62.4 t80 -112.71 157.71 20.95 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.99 -1.069 . . . . 0.0 109.979 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -136.36 140.22 43.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.187 -0.946 . . . . 0.0 110.471 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.7 t -110.45 97.41 6.86 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.134 -0.979 . . . . 0.0 110.136 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -52.36 -35.87 52.32 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.036 -1.04 . . . . 0.0 110.534 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.83 ' CD1' HG13 ' A' ' 34' ' ' VAL . 93.2 m-85 -62.67 -33.06 74.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.135 -0.978 . . . . 0.0 110.243 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.3 m -100.11 -3.05 32.65 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.028 -1.045 . . . . 0.0 112.282 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 53.24 38.3 27.3 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.409 -1.432 . . . . 0.0 110.75 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 t -129.32 173.53 10.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.158 -0.964 . . . . 0.0 110.03 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.409 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -123.69 108.68 12.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 110.099 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.57 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.7 mp -69.57 157.08 37.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.147 -0.971 . . . . 0.0 109.905 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.489 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -101.95 -31.15 10.82 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.21 -0.931 . . . . 0.0 111.875 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.534 ' O ' HG11 ' A' ' 20' ' ' VAL . 48.2 m-70 -112.03 98.47 7.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.744 -1.223 . . . . 0.0 110.33 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.36 71.06 9.42 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.232 -0.918 . . . . 0.0 110.429 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -110.33 179.87 0.76 Allowed Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.085 -1.009 . . . . 0.0 109.908 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 45.3 Cg_endo -72.81 -30.13 11.76 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.303 1.159 . . . . 0.0 111.421 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -89.84 -40.88 12.15 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.929 -1.107 . . . . 0.0 110.088 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.534 HG11 ' O ' ' A' ' 15' ' ' HIS . 77.8 t -58.67 -50.52 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.123 -0.986 . . . . 0.0 109.759 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -57.56 -51.58 68.88 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.098 -1.001 . . . . 0.0 109.628 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -62.1 -41.09 97.86 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.828 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -54.83 -42.97 72.56 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.137 -0.977 . . . . 0.0 108.552 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.37 -36.12 81.27 Favored 'General case' 0 N--CA 1.503 2.215 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.161 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -99.4 44.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.121 -0.987 . . . . 0.0 110.573 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.55 38.19 3.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.106 -0.996 . . . . 0.0 110.137 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.1 127.28 3.06 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -54.41 -28.29 42.72 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.209 -1.171 . . . . 0.0 110.338 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -60.66 -32.18 71.38 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.994 -1.066 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.541 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.0 t-80 -49.8 -37.14 28.88 Favored 'General case' 0 N--CA 1.518 2.939 0 O-C-N 120.884 -1.135 . . . . 0.0 110.914 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -61.83 -55.62 27.94 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.11 -0.994 . . . . 0.0 109.23 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.63 -38.83 82.43 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.189 -0.944 . . . . 0.0 109.193 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -55.95 -37.27 68.77 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.153 -0.967 . . . . 0.0 110.13 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.83 HG13 ' CD1' ' A' ' 8' ' ' TYR . 75.8 t -56.15 -35.26 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 121.021 -1.049 . . . . 0.0 110.186 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 35.7 tttt -53.38 -41.51 65.98 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.875 -1.14 . . . . 0.0 109.93 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.4 -29.32 65.96 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -70.92 -52.26 21.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.876 -1.14 . . . . 0.0 110.321 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.9 p90 -99.61 33.79 2.41 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.013 -1.055 . . . . 0.0 111.406 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -79.86 -38.15 33.4 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.754 -1.216 . . . . 0.0 110.171 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -116.5 26.36 9.94 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.244 -0.91 . . . . 0.0 111.372 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.63 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 13.0 t90 -56.09 -43.14 77.75 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.873 -1.142 . . . . 0.0 110.218 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.63 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 19.8 ptp -152.75 38.59 0.53 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.156 -0.965 . . . . 0.0 110.74 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 51.31 39.74 24.73 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.02 -1.05 . . . . 0.0 110.965 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -144.43 -165.63 2.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.155 -0.966 . . . . 0.0 110.304 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -117.29 123.98 47.88 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.221 -0.924 . . . . 0.0 110.253 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.404 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -129.91 79.04 1.88 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.418 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 4.1 tt0 -109.34 36.33 2.96 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.11 -0.994 . . . . 0.0 110.463 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.4 t -114.65 -54.98 2.53 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.124 -0.985 . . . . 0.0 109.793 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -22.46 60.74 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 111.479 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.582 HD12 HG11 ' A' ' 34' ' ' VAL . 42.3 mm -65.15 -51.38 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 O-C-N 120.648 -1.282 . . . . 0.0 109.367 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -56.2 -39.27 72.17 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.104 -0.997 . . . . 0.0 110.406 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.2 tptt -62.98 -36.01 82.09 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.211 -0.93 . . . . 0.0 110.517 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.0 m . . . . . 0 N--CA 1.505 2.304 0 O-C-N 121.069 -1.019 . . . . 0.0 110.16 179.854 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.505 2.287 0 CA-C-O 121.066 0.46 . . . . 0.0 110.754 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 52.7 t80 -104.64 156.43 17.98 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.998 -1.064 . . . . 0.0 110.038 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -127.46 137.41 52.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.149 -0.969 . . . . 0.0 110.412 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.35 97.98 6.65 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -54.77 -36.36 64.79 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.056 -1.027 . . . . 0.0 110.284 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.806 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.3 m-85 -60.26 -32.84 71.55 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.029 -1.045 . . . . 0.0 110.111 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HB3' HG22 ' A' ' 11' ' ' THR . 35.9 m -95.79 -1.41 49.75 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.037 -1.04 . . . . 0.0 112.033 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t0 52.39 39.02 26.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.428 -1.42 . . . . 0.0 110.574 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.4 t -146.4 171.86 14.38 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.203 -0.936 . . . . 0.0 110.098 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.2 OUTLIER -120.44 122.61 41.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.15 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -71.34 170.72 12.55 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.174 -0.954 . . . . 0.0 109.826 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.453 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.3 t -100.22 -29.89 12.21 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.296 -0.877 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.656 ' HB2' HG11 ' A' ' 20' ' ' VAL . 39.4 m-70 -113.25 147.66 37.1 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.696 -1.252 . . . . 0.0 110.404 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -123.62 94.58 4.28 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.28 -0.888 . . . . 0.0 109.9 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.12 177.67 1.72 Allowed Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.258 -0.901 . . . . 0.0 110.212 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.4 Cg_endo -70.97 -31.94 14.34 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 O-C-N 123.435 1.229 . . . . 0.0 110.933 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -89.28 -39.62 13.36 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.014 -1.054 . . . . 0.0 110.073 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.43 -46.54 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.067 -1.021 . . . . 0.0 109.692 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 15.3 mtp180 -60.55 -49.46 77.47 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.084 -1.01 . . . . 0.0 109.574 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttt -62.28 -41.15 98.24 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.891 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.2 m -54.58 -42.28 70.87 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.087 -1.008 . . . . 0.0 108.442 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.35 -35.26 79.79 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.394 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -100.18 43.54 1.05 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.123 -0.985 . . . . 0.0 110.56 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -114.93 40.39 2.64 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.09 -1.006 . . . . 0.0 109.824 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -131.38 157.04 22.13 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 ttm-85 -85.51 -10.13 56.45 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.254 -1.145 . . . . 0.0 111.026 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -90.53 -26.01 19.95 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.691 -1.255 . . . . 0.0 111.11 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.0 t-80 -49.76 -38.88 35.74 Favored 'General case' 0 N--CA 1.517 2.916 0 O-C-N 120.814 -1.179 . . . . 0.0 110.574 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -64.58 -53.72 43.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.816 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.09 -39.97 91.94 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.196 -0.94 . . . . 0.0 108.999 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -56.53 -37.88 71.08 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.205 -0.935 . . . . 0.0 110.031 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HD12 ' A' ' 50' ' ' ILE . 93.5 t -57.66 -33.73 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.125 -0.984 . . . . 0.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.0 tttt -52.24 -42.26 63.45 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.87 -1.144 . . . . 0.0 109.849 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.08 -29.53 63.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.336 -0.852 . . . . 0.0 110.375 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -69.38 -52.02 31.08 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.942 -1.099 . . . . 0.0 110.319 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.7 p90 -99.72 35.0 2.1 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.077 -1.014 . . . . 0.0 111.382 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -88.11 -38.34 15.47 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.807 -1.183 . . . . 0.0 109.884 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -112.91 31.58 6.3 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 110.765 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -92.85 -41.7 9.93 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.142 -0.974 . . . . 0.0 110.026 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.445 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -154.95 -65.76 0.13 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.14 -0.975 . . . . 0.0 110.599 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -126.57 -171.55 2.43 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.965 . . . . 0.0 110.005 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.25 38.81 3.44 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.1 -1.0 . . . . 0.0 110.342 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -152.96 75.23 1.08 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.237 -0.914 . . . . 0.0 110.484 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.55 75.43 1.54 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.199 -0.938 . . . . 0.0 110.224 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -111.36 35.86 3.44 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.095 -1.003 . . . . 0.0 110.435 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.54 -55.47 2.5 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.201 -0.937 . . . . 0.0 109.24 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.98 64.51 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.307 -0.871 . . . . 0.0 111.189 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.815 HD12 HG11 ' A' ' 34' ' ' VAL . 47.8 mm -71.6 -40.27 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.62 -1.3 . . . . 0.0 109.618 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -72.76 -39.83 66.5 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.128 -0.983 . . . . 0.0 110.013 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -57.02 -36.22 70.18 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.179 -0.951 . . . . 0.0 110.63 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 90.0 m . . . . . 0 N--CA 1.504 2.25 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.921 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mttp . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CE1' ' NH2' ' A' ' 21' ' ' ARG . 43.5 t80 -114.36 156.36 24.58 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.244 -0.91 . . . . 0.0 110.01 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -135.43 136.79 41.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.399 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -112.27 95.39 5.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.209 -0.932 . . . . 0.0 110.222 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.94 -36.16 59.55 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 121.026 -1.046 . . . . 0.0 110.383 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.69 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.1 m-85 -60.45 -32.18 71.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.149 -0.97 . . . . 0.0 110.067 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -97.66 -1.54 43.41 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.064 -1.023 . . . . 0.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.92 38.51 27.16 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.377 -1.452 . . . . 0.0 110.567 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -139.5 173.07 11.92 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.162 -0.961 . . . . 0.0 109.964 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.96 119.53 30.69 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.279 -0.888 . . . . 0.0 110.254 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.4 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -78.1 163.98 25.39 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.11 -0.994 . . . . 0.0 109.383 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.508 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -101.05 -21.79 14.91 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.132 -0.98 . . . . 0.0 112.166 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.563 ' HB2' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -120.53 139.6 52.67 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.628 -1.295 . . . . 0.0 110.145 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -120.6 93.19 3.96 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.253 -0.904 . . . . 0.0 109.78 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.404 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -139.51 178.39 1.65 Allowed Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.321 -0.862 . . . . 0.0 109.993 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.1 Cg_endo -70.62 -26.82 23.09 Favored 'Trans proline' 0 C--N 1.315 -1.196 0 O-C-N 123.351 1.185 . . . . 0.0 111.308 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.08 -40.71 9.92 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.893 -1.129 . . . . 0.0 110.16 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 15' ' ' HIS . 83.9 t -60.12 -48.39 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.031 -1.043 . . . . 0.0 109.884 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.421 ' NH2' ' CE1' ' A' ' 4' ' ' PHE . 19.6 mtp180 -56.99 -51.69 68.22 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.132 -0.98 . . . . 0.0 109.86 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -60.18 -40.55 90.38 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.179 -0.95 . . . . 0.0 109.048 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 42.1 m -54.69 -42.92 72.03 Favored 'General case' 0 N--CA 1.513 2.675 0 O-C-N 121.035 -1.041 . . . . 0.0 108.369 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -63.73 -38.61 91.76 Favored 'General case' 0 N--CA 1.502 2.175 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.004 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.02 51.93 1.27 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.298 -0.876 . . . . 0.0 110.488 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 37.69 3.82 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.06 -1.025 . . . . 0.0 110.327 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.68 122.8 1.75 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -50.87 -30.26 14.09 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.118 -1.225 . . . . 0.0 110.847 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -33.16 69.6 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.095 -1.003 . . . . 0.0 110.503 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.06 -38.28 37.37 Favored 'General case' 0 N--CA 1.517 2.887 0 O-C-N 121.016 -1.053 . . . . 0.0 110.694 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -62.55 -53.17 58.71 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.161 -0.962 . . . . 0.0 108.972 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -60.61 -39.66 89.01 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.221 -0.924 . . . . 0.0 109.0 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.13 -38.43 68.21 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.207 -0.933 . . . . 0.0 110.099 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD12 ' A' ' 50' ' ' ILE . 74.6 t -59.27 -37.9 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 109.894 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 1.5 tppp? -56.99 -41.79 79.06 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.973 -1.08 . . . . 0.0 109.509 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.27 -29.81 67.84 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.251 -0.905 . . . . 0.0 110.101 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -68.54 -52.53 30.97 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.957 -1.089 . . . . 0.0 110.28 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.667 ' HE1' HG12 ' A' ' 34' ' ' VAL . 38.1 p90 -98.53 24.82 6.97 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.085 -1.01 . . . . 0.0 111.82 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -65.34 -41.23 94.11 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 120.626 -1.296 . . . . 0.0 109.745 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 mtmt -122.63 26.3 8.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.35 -0.844 . . . . 0.0 111.164 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.0 t90 -64.4 -40.6 96.11 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.888 -1.133 . . . . 0.0 110.219 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.449 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 mtm -156.29 -56.53 0.09 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.138 -0.976 . . . . 0.0 110.845 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -126.08 -171.84 2.48 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.138 -0.976 . . . . 0.0 110.532 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -34.19 11.25 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.158 -0.964 . . . . 0.0 111.015 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -93.32 96.17 9.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.927 -1.108 . . . . 0.0 110.189 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -141.48 71.21 1.35 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -121.18 34.14 5.31 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.21 -0.931 . . . . 0.0 110.635 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -106.76 -51.48 2.93 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.125 -0.984 . . . . 0.0 109.558 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -21.14 62.73 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.215 -0.928 . . . . 0.0 111.499 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.794 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.85 -56.3 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 O-C-N 120.665 -1.272 . . . . 0.0 109.77 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.34 -36.71 71.51 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -73.01 -34.04 66.13 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.647 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.6 m . . . . . 0 N--CA 1.505 2.317 0 O-C-N 120.939 -1.101 . . . . 0.0 110.163 179.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 35.0 mmtm . . . . . 0 N--CA 1.494 1.736 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.689 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.9 t80 -116.26 161.95 18.23 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -132.72 136.15 46.21 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.237 -0.915 . . . . 0.0 110.212 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.39 97.24 6.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.199 -0.938 . . . . 0.0 109.905 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -51.39 -35.57 39.47 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.121 -0.987 . . . . 0.0 110.554 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.534 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.3 m-85 -62.7 -30.8 71.68 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.145 -0.972 . . . . 0.0 110.249 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.3 m -100.02 -8.98 23.2 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.952 -1.093 . . . . 0.0 112.118 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.95 42.44 31.06 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.391 -1.443 . . . . 0.0 110.087 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -145.35 172.43 13.17 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.289 -0.882 . . . . 0.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.457 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 3.5 t80 -118.29 129.49 55.49 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.255 -0.903 . . . . 0.0 110.305 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.689 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.5 mp -85.9 170.2 12.58 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.173 -0.955 . . . . 0.0 109.861 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.591 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -97.26 -21.96 16.96 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.198 -0.939 . . . . 0.0 111.696 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.792 ' HB2' HG11 ' A' ' 20' ' ' VAL . 52.7 m-70 -122.16 147.29 46.34 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.619 -1.301 . . . . 0.0 110.097 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -127.08 93.54 3.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.208 -0.933 . . . . 0.0 109.81 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.406 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -148.19 179.1 1.25 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.284 -0.885 . . . . 0.0 110.17 -179.643 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -71.03 -32.09 13.9 Favored 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.326 1.171 . . . . 0.0 110.811 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 -39.72 17.1 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.975 -1.078 . . . . 0.0 109.956 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.792 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.5 t -64.9 -47.12 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 O-C-N 121.11 -0.993 . . . . 0.0 109.678 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.451 ' NH1' ' CD2' ' A' ' 4' ' ' PHE . 11.7 mtp180 -57.61 -51.96 67.39 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.072 -1.017 . . . . 0.0 109.588 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -60.77 -40.36 92.23 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.184 -0.948 . . . . 0.0 108.82 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -55.18 -43.38 74.3 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.141 -0.975 . . . . 0.0 108.546 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.448 ' ND1' HD21 ' A' ' 13' ' ' LEU . 70.8 t60 -61.69 -37.29 83.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.426 -0.796 . . . . 0.0 109.061 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.25 50.06 1.07 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.187 -0.946 . . . . 0.0 110.369 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.71 37.63 3.88 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.051 -1.031 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.68 128.44 3.35 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.2 tpp85 -54.47 -28.52 45.15 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.141 -1.211 . . . . 0.0 110.413 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -59.5 -35.77 74.79 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.977 -1.077 . . . . 0.0 110.355 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.448 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.78 -46.09 64.03 Favored 'General case' 0 N--CA 1.514 2.725 0 O-C-N 120.931 -1.106 . . . . 0.0 110.489 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -54.57 45.59 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.086 -1.009 . . . . 0.0 109.427 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -60.09 -39.47 86.23 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.186 -0.946 . . . . 0.0 109.073 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -56.85 -38.67 73.0 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.948 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.597 HG12 ' HE2' ' A' ' 38' ' ' TYR . 65.9 t -59.06 -38.21 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.554 0 O-C-N 121.139 -0.976 . . . . 0.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 29.3 ttmt -54.97 -40.58 70.16 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.949 -1.095 . . . . 0.0 109.832 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -58.11 -30.16 66.06 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.304 -0.873 . . . . 0.0 110.229 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.24 -53.51 24.15 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.931 -1.106 . . . . 0.0 110.177 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.822 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 39.2 p90 -98.14 22.79 9.01 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.137 -0.977 . . . . 0.0 111.702 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.78 -38.4 90.47 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.593 -1.317 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -113.89 33.28 5.3 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.157 -0.964 . . . . 0.0 110.742 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.478 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 24.5 t90 -92.16 -40.51 10.97 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.19 -0.944 . . . . 0.0 110.151 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.478 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 3.0 ttm -151.78 -62.98 0.17 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.17 -0.956 . . . . 0.0 110.664 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -122.24 -172.9 2.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.0 110.524 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -98.32 -37.35 9.68 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.225 -0.922 . . . . 0.0 110.783 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -105.47 92.81 4.35 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.092 -1.005 . . . . 0.0 110.219 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.822 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -128.52 74.85 1.59 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -0.919 . . . . 0.0 110.13 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.16 35.54 3.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.099 -1.001 . . . . 0.0 110.492 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.0 t -110.5 -54.64 2.56 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.096 -1.002 . . . . 0.0 109.395 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -20.7 64.34 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.25 -0.906 . . . . 0.0 111.393 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.545 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -72.33 -44.91 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 120.681 -1.262 . . . . 0.0 109.788 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -62.79 -48.59 78.48 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.168 -0.957 . . . . 0.0 109.887 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -56.52 -33.48 66.08 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.143 -0.973 . . . . 0.0 110.632 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.3 m . . . . . 0 N--CA 1.503 2.204 0 O-C-N 120.945 -1.097 . . . . 0.0 110.351 179.869 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.4 mttt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.8 t80 -110.4 161.65 15.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.103 -0.998 . . . . 0.0 110.522 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD2' ' A' ' 4' ' ' PHE . 34.9 t80 -133.7 134.06 42.62 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.252 -0.905 . . . . 0.0 110.115 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.9 t -113.53 96.39 5.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -0.975 . . . . 0.0 110.177 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -53.71 -36.34 62.13 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.388 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.6 m-85 -60.74 -32.4 71.67 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.091 -1.006 . . . . 0.0 110.156 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' HG22 ' A' ' 11' ' ' THR . 33.5 m -96.99 -5.94 36.62 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.076 -1.015 . . . . 0.0 112.116 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 54.75 39.98 31.67 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.349 -1.47 . . . . 0.0 110.23 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.409 HG22 ' HB3' ' A' ' 9' ' ' CYS . 9.1 t -143.42 172.24 13.05 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.236 -0.915 . . . . 0.0 109.918 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -117.34 138.82 51.53 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.271 -0.893 . . . . 0.0 110.469 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.0 mp -97.68 168.42 10.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.222 -0.924 . . . . 0.0 109.769 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.515 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -99.38 -29.07 12.98 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.217 -0.927 . . . . 0.0 111.73 -179.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.71 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.6 m-70 -112.06 148.42 33.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.774 -1.204 . . . . 0.0 110.431 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -126.92 93.93 3.89 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.331 -0.856 . . . . 0.0 109.761 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -150.82 178.52 1.49 Allowed Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.272 -0.893 . . . . 0.0 110.305 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.07 -33.3 11.94 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.354 1.186 . . . . 0.0 110.735 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.7 t -83.16 -38.59 22.15 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.011 -1.056 . . . . 0.0 110.033 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.71 HG11 ' HB2' ' A' ' 15' ' ' HIS . 62.2 t -64.1 -47.38 90.43 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -57.97 -50.07 74.62 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.097 -1.002 . . . . 0.0 109.53 179.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.12 -40.99 97.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.214 -0.929 . . . . 0.0 108.655 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -55.48 -43.84 75.92 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.159 -0.963 . . . . 0.0 108.487 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -62.59 -39.49 93.88 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.353 -0.842 . . . . 0.0 108.863 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.5 t -92.42 56.0 2.65 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.278 -0.889 . . . . 0.0 110.335 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -118.5 37.42 4.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.127 -0.983 . . . . 0.0 110.414 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.15 128.27 3.23 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -54.54 -28.18 43.7 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.153 -1.204 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.941 -1.1 . . . . 0.0 110.522 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.454 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.1 t-80 -51.47 -40.66 59.92 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.951 -1.093 . . . . 0.0 110.523 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.2 tttt -62.75 -55.61 25.03 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.196 -0.94 . . . . 0.0 109.064 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -59.34 -38.85 81.38 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.2 -0.938 . . . . 0.0 109.189 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.62 -38.23 71.81 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.8 HG11 HD12 ' A' ' 50' ' ' ILE . 79.5 t -64.46 -39.57 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 O-C-N 121.134 -0.978 . . . . 0.0 109.641 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.3 ttpt -58.38 -42.79 87.86 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.069 -1.019 . . . . 0.0 109.348 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.02 -30.2 67.84 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.529 -0.869 . . . . 0.0 110.283 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -70.41 -51.82 26.81 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.901 -1.125 . . . . 0.0 110.322 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.721 ' HE1' HG12 ' A' ' 34' ' ' VAL . 40.3 p90 -100.03 34.54 2.28 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.13 -0.981 . . . . 0.0 111.295 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -78.3 -39.63 39.2 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.814 -1.179 . . . . 0.0 110.0 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tttm -117.82 22.69 12.15 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.243 -0.91 . . . . 0.0 111.53 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 13.1 t90 -57.61 -55.29 36.75 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.796 -1.19 . . . . 0.0 110.151 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.457 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 13.2 mtt -149.1 -63.1 0.23 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -122.79 -171.95 2.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.161 -0.962 . . . . 0.0 110.06 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -110.76 39.72 2.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.227 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -145.55 75.02 1.41 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.917 . . . . 0.0 110.174 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.46 71.73 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.239 -0.913 . . . . 0.0 110.343 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.76 34.71 5.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.254 -0.904 . . . . 0.0 110.574 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 7.2 p -108.12 -52.57 2.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.056 -1.027 . . . . 0.0 109.418 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.408 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -60.92 -21.12 63.08 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.195 -0.941 . . . . 0.0 111.418 179.376 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.8 HD12 HG11 ' A' ' 34' ' ' VAL . 49.5 mm -76.12 -52.22 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.659 -1.276 . . . . 0.0 109.597 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -58.45 -39.39 79.72 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.2 -0.937 . . . . 0.0 110.195 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -55.88 -36.34 67.49 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.076 -1.015 . . . . 0.0 110.625 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.1 m . . . . . 0 N--CA 1.504 2.272 0 O-C-N 121.08 -1.013 . . . . 0.0 110.172 179.871 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.5 mttt . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 78.2 t80 -115.65 162.06 17.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.112 -0.993 . . . . 0.0 110.089 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -136.18 132.83 36.47 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.202 -0.936 . . . . 0.0 110.187 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.1 t -112.44 94.1 4.76 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.085 -1.009 . . . . 0.0 110.051 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -52.06 -35.98 49.13 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.074 -1.016 . . . . 0.0 110.518 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.765 ' CD1' HG13 ' A' ' 34' ' ' VAL . 83.5 m-85 -61.07 -32.8 72.44 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.18 -0.95 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.5 m -97.47 -4.08 38.76 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.001 -1.062 . . . . 0.0 112.261 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 53.54 38.99 29.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.446 -1.409 . . . . 0.0 110.479 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -140.68 170.33 15.98 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.904 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.11 137.08 53.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -95.12 163.98 13.06 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.465 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.41 -31.65 11.2 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.041 -1.037 . . . . 0.0 111.724 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.5 m-70 -114.61 132.96 56.18 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.718 -1.239 . . . . 0.0 110.194 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.84 95.94 5.69 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.257 -0.902 . . . . 0.0 109.809 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -141.58 179.37 1.24 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.2 -0.937 . . . . 0.0 109.966 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.17 -28.04 19.25 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.314 1.165 . . . . 0.0 111.176 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.88 -41.94 10.89 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.901 -1.125 . . . . 0.0 109.974 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.436 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.1 t -60.92 -50.96 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.524 0 O-C-N 121.178 -0.951 . . . . 0.0 109.66 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -57.09 -51.11 70.61 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.125 -0.984 . . . . 0.0 109.607 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -61.33 -40.57 94.7 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.797 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 92.5 m -54.77 -43.56 72.87 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.121 -0.987 . . . . 0.0 108.443 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -63.47 -39.72 95.21 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.08 52.12 1.27 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -117.83 37.63 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.154 -0.966 . . . . 0.0 110.347 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.67 127.28 2.68 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.944 -1.263 . . . . 0.0 109.944 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -54.37 -28.69 44.87 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.033 -1.275 . . . . 0.0 110.169 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -58.46 -33.87 70.23 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 120.99 -1.068 . . . . 0.0 110.464 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -50.47 -38.71 45.35 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.925 -1.109 . . . . 0.0 110.75 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -63.16 -54.28 40.08 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.104 -0.998 . . . . 0.0 108.945 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -60.13 -38.98 84.69 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.11 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.11 -38.33 70.61 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.24 -0.913 . . . . 0.0 110.117 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.765 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.5 t -59.14 -37.32 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.062 -1.024 . . . . 0.0 109.879 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.3 ttpp -53.41 -39.97 64.73 Favored 'General case' 0 N--CA 1.513 2.724 0 O-C-N 120.887 -1.133 . . . . 0.0 109.845 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -58.47 -30.79 67.25 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.293 -0.879 . . . . 0.0 110.222 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -68.05 -53.26 27.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.984 -1.072 . . . . 0.0 109.967 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' OH ' ' HG3' ' A' ' 47' ' ' GLN . 41.7 p90 -100.08 33.29 2.66 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.097 -1.002 . . . . 0.0 111.248 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -73.62 -39.11 64.8 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.771 -1.205 . . . . 0.0 110.112 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -110.16 32.35 5.2 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.553 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' HE3' ' A' ' 42' ' ' MET . 21.7 t90 -107.27 -57.9 2.02 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.152 -0.968 . . . . 0.0 110.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.463 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 2.1 ttm -140.5 63.08 1.48 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.271 -0.893 . . . . 0.0 109.627 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -45.17 -34.15 2.59 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.363 -0.836 . . . . 0.0 111.587 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -81.35 129.41 34.61 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.042 -1.036 . . . . 0.0 109.32 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 54.71 71.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.976 -1.078 . . . . 0.0 110.213 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -131.25 -174.02 3.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.362 -0.836 . . . . 0.0 110.445 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.453 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 56.76 34.03 23.95 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.346 -0.846 . . . . 0.0 110.542 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.96 -56.57 2.31 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.11 -0.993 . . . . 0.0 109.368 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -22.2 62.12 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.223 -0.923 . . . . 0.0 111.213 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.743 HD12 HG11 ' A' ' 34' ' ' VAL . 42.5 mm -64.13 -42.78 96.66 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 120.702 -1.249 . . . . 0.0 108.991 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.73 -37.25 73.25 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.335 -0.853 . . . . 0.0 110.391 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -72.1 -34.55 68.73 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.617 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.4 m . . . . . 0 N--CA 1.506 2.373 0 O-C-N 121.006 -1.059 . . . . 0.0 110.167 179.919 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 mttt . . . . . 0 N--CA 1.501 2.115 0 CA-C-O 120.939 0.4 . . . . 0.0 110.844 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.571 ' HD1' HD13 ' A' ' 13' ' ' LEU . 77.5 t80 -125.57 162.45 24.91 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.128 -0.982 . . . . 0.0 110.137 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -131.91 135.71 46.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.226 -0.921 . . . . 0.0 110.535 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -112.79 95.55 5.48 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.175 -0.953 . . . . 0.0 109.731 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.85 -35.24 31.51 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.16 -0.962 . . . . 0.0 110.725 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.858 ' CD1' HG13 ' A' ' 34' ' ' VAL . 74.3 m-85 -63.54 -30.64 71.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.094 -1.004 . . . . 0.0 110.155 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.6 m -100.01 -8.83 23.38 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.968 -1.082 . . . . 0.0 112.107 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 t0 55.91 40.64 30.5 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.368 -1.458 . . . . 0.0 110.121 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.04 173.64 11.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.313 -0.867 . . . . 0.0 109.957 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -120.64 131.13 54.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.685 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.571 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -88.42 172.04 9.67 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.239 -0.913 . . . . 0.0 109.567 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -98.3 -31.93 11.8 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.148 -0.97 . . . . 0.0 111.469 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 28.1 m-70 -121.04 134.65 55.29 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.807 -1.183 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.401 ' OD1' ' CD2' ' A' ' 4' ' ' PHE . 24.0 t0 -113.06 97.27 6.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.149 -0.97 . . . . 0.0 109.895 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -144.34 179.4 1.18 Allowed Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.225 -0.922 . . . . 0.0 110.015 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.19 -31.32 14.69 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.303 1.16 . . . . 0.0 110.853 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.8 t -86.16 -38.97 17.15 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.923 -1.11 . . . . 0.0 110.069 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 15' ' ' HIS . 80.7 t -67.61 -46.35 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.119 -0.988 . . . . 0.0 109.751 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.0 mtp180 -56.92 -52.34 65.57 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.054 -1.028 . . . . 0.0 109.757 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -60.67 -40.19 91.21 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.156 -0.965 . . . . 0.0 108.871 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.6 m -55.09 -43.37 73.89 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.101 -0.999 . . . . 0.0 108.515 178.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -62.29 -38.48 89.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.396 -0.815 . . . . 0.0 109.004 178.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -94.92 52.81 1.51 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.22 -0.925 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -117.66 39.47 3.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 109.899 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -132.78 160.11 23.71 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -88.32 -10.99 47.64 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.334 -1.098 . . . . 0.0 110.83 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtpp -91.14 -24.35 19.99 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.582 -1.324 . . . . 0.0 111.212 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.693 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.5 t-80 -48.9 -38.51 22.86 Favored 'General case' 0 N--CA 1.517 2.897 0 O-C-N 120.813 -1.179 . . . . 0.0 110.813 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -64.94 -54.41 31.04 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.24 -0.984 . . . . 0.0 108.906 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.03 -39.26 89.13 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.229 -0.92 . . . . 0.0 109.073 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -56.98 -37.18 71.27 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.13 -0.981 . . . . 0.0 110.021 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.858 HG13 ' CD1' ' A' ' 8' ' ' TYR . 71.8 t -55.85 -37.98 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 O-C-N 120.975 -1.078 . . . . 0.0 110.079 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.0 tttt -58.98 -42.96 91.21 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.057 -1.027 . . . . 0.0 109.293 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -59.35 -26.3 64.93 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.467 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -74.43 -51.92 13.54 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.875 -1.141 . . . . 0.0 110.426 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 34.4 p90 -99.41 31.98 2.93 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.057 -1.027 . . . . 0.0 111.495 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -76.16 -40.25 52.98 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.724 -1.235 . . . . 0.0 110.131 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mttp -84.65 -32.04 23.86 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.248 -0.908 . . . . 0.0 110.182 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 5.9 t90 -50.21 -45.31 53.63 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.971 -1.081 . . . . 0.0 111.058 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.468 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -114.72 -55.3 2.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 110.341 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 53.65 38.34 28.1 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.978 -1.076 . . . . 0.0 110.739 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -157.55 -56.66 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.183 -0.948 . . . . 0.0 110.761 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -164.18 82.77 0.42 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.165 -0.959 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.461 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -138.77 72.53 1.41 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.29 36.63 4.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.259 -0.901 . . . . 0.0 110.277 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.39 -53.85 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.148 -0.97 . . . . 0.0 109.745 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.37 -21.41 62.1 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.255 -0.903 . . . . 0.0 111.522 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.698 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -71.75 -50.68 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 O-C-N 120.608 -1.308 . . . . 0.0 109.521 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -64.86 -39.39 93.48 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.274 -0.891 . . . . 0.0 109.915 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -33.43 64.26 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.095 -1.003 . . . . 0.0 110.731 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.505 2.28 0 O-C-N 120.968 -1.083 . . . . 0.0 110.682 179.988 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 61.4 mttt . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.592 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.2 t80 -108.04 161.45 14.94 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.28 -0.888 . . . . 0.0 110.164 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -135.05 137.45 42.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.283 -0.886 . . . . 0.0 110.002 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.7 t -119.26 96.91 5.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.101 -0.999 . . . . 0.0 110.294 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.87 -35.9 62.05 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.053 -1.029 . . . . 0.0 110.293 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.608 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.6 m-85 -60.59 -32.89 71.98 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.122 -0.986 . . . . 0.0 110.117 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.2 m -97.34 -4.37 38.69 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.061 -1.025 . . . . 0.0 112.198 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 53.45 39.4 29.9 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.376 -1.452 . . . . 0.0 110.573 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.76 170.06 16.4 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.294 -0.879 . . . . 0.0 109.992 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 14.6 t80 -118.41 134.05 55.38 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.322 -0.861 . . . . 0.0 110.423 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.592 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.7 mp -90.09 161.81 15.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.191 -0.943 . . . . 0.0 109.664 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.434 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.69 -21.95 16.16 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.101 -0.999 . . . . 0.0 111.888 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.776 ' HB2' HG11 ' A' ' 20' ' ' VAL . 42.7 m-70 -115.28 143.94 44.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.635 -1.291 . . . . 0.0 110.11 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -125.78 92.29 3.57 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 109.715 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.57 178.57 1.45 Allowed Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.229 -0.919 . . . . 0.0 110.043 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -70.82 -28.67 19.84 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.438 1.23 . . . . 0.0 111.078 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.61 -41.6 10.67 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.882 -1.136 . . . . 0.0 110.004 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.776 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.9 t -59.44 -54.05 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.093 -1.005 . . . . 0.0 109.728 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 20.4 mtp-105 -56.17 -50.52 70.95 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.163 -0.961 . . . . 0.0 109.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -61.99 -40.44 95.64 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.334 -0.946 . . . . 0.0 108.818 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.4 m -54.5 -43.07 71.49 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.117 -0.989 . . . . 0.0 108.368 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -62.45 -37.55 86.33 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.392 -0.818 . . . . 0.0 108.886 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -99.26 45.17 1.0 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.261 -0.899 . . . . 0.0 110.448 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -116.6 38.14 3.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.215 -0.928 . . . . 0.0 110.182 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.17 128.71 3.79 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.9 ttp85 -55.38 -27.49 47.87 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.225 -1.162 . . . . 0.0 110.545 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -62.53 -33.53 75.09 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.996 -1.065 . . . . 0.0 110.669 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.622 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.2 t-80 -51.32 -39.0 56.0 Favored 'General case' 0 N--CA 1.516 2.851 0 O-C-N 120.877 -1.139 . . . . 0.0 110.508 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -63.21 -55.1 27.81 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.35 -0.94 . . . . 0.0 109.057 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.01 -39.52 86.1 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.211 -0.93 . . . . 0.0 109.111 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -56.6 -38.27 71.79 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.17 -0.956 . . . . 0.0 110.012 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.675 HG11 HD12 ' A' ' 50' ' ' ILE . 71.5 t -56.73 -35.01 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.121 -0.987 . . . . 0.0 110.123 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 33.6 tttt -53.32 -44.57 68.5 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.812 -1.18 . . . . 0.0 109.932 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.42 -28.89 65.67 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.282 -0.887 . . . . 0.0 110.407 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -74.31 -50.75 17.53 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.947 -1.096 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.602 ' CE2' HG12 ' A' ' 34' ' ' VAL . 37.9 p90 -99.31 34.42 2.18 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.029 -1.044 . . . . 0.0 111.451 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -90.97 -41.21 11.25 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.723 -1.235 . . . . 0.0 109.656 178.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -112.53 32.83 5.33 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.346 -0.846 . . . . 0.0 110.26 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 16.2 t90 -97.7 -41.87 7.89 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.185 -0.947 . . . . 0.0 110.439 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.462 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -115.69 -67.96 0.96 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.063 -1.023 . . . . 0.0 110.108 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -167.17 -60.66 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.15 -0.969 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.21 -51.52 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.074 -1.016 . . . . 0.0 111.093 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -81.12 89.0 5.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.111 -0.993 . . . . 0.0 110.3 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.401 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -145.78 69.42 1.22 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.236 -0.915 . . . . 0.0 110.136 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -122.32 35.38 4.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.552 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -108.16 -52.68 2.73 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.194 -0.941 . . . . 0.0 109.499 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -20.94 63.34 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 111.478 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.675 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.77 -56.18 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 120.699 -1.251 . . . . 0.0 109.806 179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -56.97 -39.43 74.59 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.167 -0.958 . . . . 0.0 110.312 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -57.13 -36.47 70.73 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.117 -0.99 . . . . 0.0 110.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.505 2.284 0 O-C-N 121.063 -1.023 . . . . 0.0 110.541 179.806 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.441 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 16.8 mtmt . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -110.88 152.07 27.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.221 -0.924 . . . . 0.0 109.629 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -128.95 136.0 49.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.2 t -110.15 94.5 5.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 110.168 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -51.73 -35.57 43.72 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.051 -1.03 . . . . 0.0 110.459 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.86 ' CD1' HG13 ' A' ' 34' ' ' VAL . 78.3 m-85 -61.85 -32.2 72.51 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.174 -0.953 . . . . 0.0 110.057 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.4 m -98.29 -0.96 42.92 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.993 -1.067 . . . . 0.0 112.146 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 52.25 38.87 25.87 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.407 -1.433 . . . . 0.0 110.69 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -140.21 171.23 14.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 109.978 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.441 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.4 OUTLIER -122.1 119.14 30.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.205 -0.935 . . . . 0.0 110.145 -179.758 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -75.99 166.71 23.09 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.145 -0.972 . . . . 0.0 109.489 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -100.37 -30.38 11.88 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.153 -0.967 . . . . 0.0 111.725 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.652 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.3 m-70 -112.44 142.18 45.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.732 -1.23 . . . . 0.0 110.154 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.41 89.71 3.18 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.184 -0.948 . . . . 0.0 109.714 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -136.59 178.44 1.74 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.847 . . . . 0.0 110.046 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.53 -29.94 19.46 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.8 m -90.32 -43.63 10.22 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.923 -1.11 . . . . 0.0 109.91 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.652 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.58 -53.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.632 0 O-C-N 121.184 -0.948 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 mtp-105 -56.76 -50.22 72.91 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.145 -0.972 . . . . 0.0 109.699 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -61.93 -40.29 94.98 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.316 -0.954 . . . . 0.0 108.802 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.7 m -54.53 -42.66 71.16 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.013 -1.054 . . . . 0.0 108.684 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -61.69 -37.63 84.83 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.167 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.32 53.12 1.47 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.234 -0.916 . . . . 0.0 110.423 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.71 38.22 3.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.1 -1.0 . . . . 0.0 110.101 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.25 130.01 4.45 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 -59.29 -23.98 62.88 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.231 -1.158 . . . . 0.0 110.854 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -71.06 -27.48 63.67 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 120.819 -1.176 . . . . 0.0 111.45 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.7 t-80 -49.55 -37.89 28.88 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.735 -1.228 . . . . 0.0 110.806 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -63.17 -54.2 41.38 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.087 -1.008 . . . . 0.0 109.112 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -60.46 -40.14 90.14 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.144 -0.972 . . . . 0.0 109.057 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -55.98 -37.22 68.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.223 -0.923 . . . . 0.0 110.046 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.86 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.8 t -55.92 -33.64 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.589 0 O-C-N 121.129 -0.982 . . . . 0.0 110.291 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 5.0 tttt -53.2 -41.94 65.79 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.825 -1.172 . . . . 0.0 109.994 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.56 -27.77 64.89 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.437 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.02 -52.26 13.3 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.877 -1.139 . . . . 0.0 110.499 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.905 ' CE2' ' HB3' ' A' ' 46' ' ' ALA . 35.5 p90 -99.01 31.63 2.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.004 -1.06 . . . . 0.0 111.656 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.59 -38.3 59.2 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.661 -1.274 . . . . 0.0 110.027 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.7 mttt -113.28 34.24 4.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.255 -0.903 . . . . 0.0 110.563 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -98.21 -47.12 5.58 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -148.14 -63.63 0.25 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.352 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -120.24 -177.29 3.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.305 -0.872 . . . . 0.0 110.251 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -97.72 -37.73 9.77 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.19 -0.943 . . . . 0.0 110.68 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -109.72 112.33 24.33 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.049 -1.032 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.905 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -148.74 76.74 1.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.217 -0.927 . . . . 0.0 110.242 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -106.48 35.71 2.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.063 -1.023 . . . . 0.0 110.462 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.9 -55.17 2.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.069 -1.019 . . . . 0.0 109.276 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.262 -0.899 . . . . 0.0 111.316 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -70.37 -44.78 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.7 -1.25 . . . . 0.0 109.514 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -58.13 -40.8 82.2 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.189 -0.944 . . . . 0.0 110.029 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -61.19 -34.91 75.84 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.234 -0.916 . . . . 0.0 110.483 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.1 m . . . . . 0 N--CA 1.505 2.293 0 O-C-N 120.979 -1.076 . . . . 0.0 110.174 179.917 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 mttt . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.612 ' HD1' HD13 ' A' ' 13' ' ' LEU . 71.7 t80 -111.86 162.66 15.05 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.269 -0.894 . . . . 0.0 110.01 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -137.75 137.1 37.94 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.033 -1.042 . . . . 0.0 110.853 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.2 t -114.23 100.74 8.58 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.177 -0.952 . . . . 0.0 109.91 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -58.09 -37.08 73.83 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.098 -1.002 . . . . 0.0 110.704 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -61.4 -34.96 76.23 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 120.996 -1.065 . . . . 0.0 110.046 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.6 m -90.03 -4.12 57.58 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.095 -1.003 . . . . 0.0 111.826 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.9 t70 53.74 39.4 30.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.393 -1.442 . . . . 0.0 110.473 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.18 171.89 13.44 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.279 -0.888 . . . . 0.0 109.995 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.4 120.81 37.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.243 -0.911 . . . . 0.0 110.086 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.612 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -74.7 166.91 22.81 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.13 -0.981 . . . . 0.0 109.559 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.497 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -101.12 -29.44 12.13 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.106 -0.996 . . . . 0.0 111.889 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.591 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.4 m-70 -114.62 148.11 38.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.782 -1.199 . . . . 0.0 110.342 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -124.59 97.52 5.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.203 -0.936 . . . . 0.0 109.764 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.29 178.08 1.56 Allowed Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.226 -0.921 . . . . 0.0 110.263 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -70.56 -30.67 18.24 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 O-C-N 123.405 1.213 . . . . 0.0 110.93 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.7 m -90.32 -39.78 12.52 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.978 -1.076 . . . . 0.0 109.989 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.591 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.5 t -60.2 -52.34 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.034 -1.041 . . . . 0.0 109.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -57.61 -49.39 76.56 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 121.13 -0.981 . . . . 0.0 109.583 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -41.4 99.09 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.728 178.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 78.8 m -54.59 -43.33 72.05 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.157 -0.964 . . . . 0.0 108.493 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.87 -37.16 85.76 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.648 -0.821 . . . . 0.0 109.062 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 50.32 1.04 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.206 -0.934 . . . . 0.0 110.331 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.22 38.11 3.32 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.057 -1.027 . . . . 0.0 110.382 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.34 126.41 2.39 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.836 -1.305 . . . . 0.0 109.836 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -53.75 -28.92 37.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.211 -1.17 . . . . 0.0 110.263 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -59.13 -32.74 70.12 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.05 -1.031 . . . . 0.0 110.605 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.499 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.54 -37.08 25.6 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.92 -1.112 . . . . 0.0 111.043 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -60.67 -53.62 55.27 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.071 -1.018 . . . . 0.0 109.157 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -39.03 85.52 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.181 -0.95 . . . . 0.0 109.03 178.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -56.03 -37.16 68.83 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.281 -0.887 . . . . 0.0 110.18 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.852 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.3 t -58.83 -37.2 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.06 -1.025 . . . . 0.0 109.796 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CZ ' ' A' ' 38' ' ' TYR . 9.0 tttp -54.76 -40.83 69.77 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.93 -1.106 . . . . 0.0 109.716 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.59 -32.4 70.35 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.95 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -65.51 -51.32 60.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.997 -1.064 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.656 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.8 p90 -99.87 34.21 2.35 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.06 -1.025 . . . . 0.0 111.323 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -39.21 15.87 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.813 -1.179 . . . . 0.0 109.733 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -114.27 34.55 4.63 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.237 -0.914 . . . . 0.0 110.358 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.459 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.6 t90 -88.5 -47.61 8.2 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.181 -0.949 . . . . 0.0 110.162 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.459 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -151.98 -64.18 0.17 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.182 -0.949 . . . . 0.0 110.639 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -129.24 -171.48 2.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.221 -0.924 . . . . 0.0 110.147 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -109.52 -179.74 3.91 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.22 -0.925 . . . . 0.0 110.14 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 53.27 74.56 0.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.121 -0.987 . . . . 0.0 110.687 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.443 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -135.23 73.5 1.48 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.271 -0.893 . . . . 0.0 110.166 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -112.18 35.19 3.86 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.203 -0.936 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.09 -54.21 2.56 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.054 -1.029 . . . . 0.0 109.325 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -21.24 63.1 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.268 -0.895 . . . . 0.0 111.334 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.628 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -74.05 -43.31 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.646 -1.284 . . . . 0.0 109.536 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -64.53 -39.97 94.76 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.234 -0.916 . . . . 0.0 109.978 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -63.58 -33.64 76.05 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.229 -0.92 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.4 m . . . . . 0 N--CA 1.505 2.315 0 O-C-N 121.066 -1.021 . . . . 0.0 110.39 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.9 mttt . . . . . 0 N--CA 1.502 2.141 0 CA-C-O 121.002 0.429 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.58 ' HD2' HD13 ' A' ' 13' ' ' LEU . 79.9 t80 -124.89 162.21 24.9 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.11 -0.994 . . . . 0.0 109.912 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -139.7 132.43 29.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.231 -0.918 . . . . 0.0 110.434 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 t -112.84 89.88 3.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.204 -0.935 . . . . 0.0 109.973 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -51.31 -35.77 39.41 Favored 'General case' 0 N--CA 1.515 2.82 0 O-C-N 121.05 -1.031 . . . . 0.0 110.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.897 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.0 m-85 -59.92 -31.0 69.42 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.117 -0.99 . . . . 0.0 110.063 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.3 m -99.41 -0.15 41.48 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.929 -1.107 . . . . 0.0 112.239 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 52.84 38.41 26.63 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.326 -1.484 . . . . 0.0 110.656 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -142.16 170.46 15.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.224 -0.923 . . . . 0.0 110.022 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -121.45 142.92 49.56 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.212 -0.93 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.58 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -102.73 156.58 17.54 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.251 -0.906 . . . . 0.0 109.406 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.419 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -98.86 -30.83 12.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.13 -0.981 . . . . 0.0 111.594 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.456 ' O ' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -111.19 126.93 55.38 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.814 -1.179 . . . . 0.0 110.175 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -110.03 92.52 4.08 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.237 -0.915 . . . . 0.0 109.647 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.45 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -135.61 -179.72 1.15 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.43 -0.794 . . . . 0.0 109.765 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.72 -28.35 17.13 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.185 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.84 -43.55 9.97 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.881 -1.137 . . . . 0.0 110.07 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.456 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.5 t -59.14 -53.29 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.57 0 O-C-N 121.039 -1.038 . . . . 0.0 109.838 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.95 -50.14 73.54 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.074 -1.016 . . . . 0.0 109.625 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -61.91 -40.8 96.7 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.133 -0.98 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.6 m -54.56 -43.43 72.03 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.075 -1.016 . . . . 0.0 108.496 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -63.35 -40.91 98.57 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -93.25 56.61 2.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.342 -0.849 . . . . 0.0 110.197 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -119.11 37.09 4.23 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.131 -0.981 . . . . 0.0 110.401 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.29 123.37 1.74 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -51.12 -30.39 16.18 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.204 -1.174 . . . . 0.0 110.672 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -57.66 -33.79 68.7 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.013 -1.054 . . . . 0.0 110.596 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.49 -42.43 54.68 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.92 -1.113 . . . . 0.0 110.728 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -62.97 -53.31 56.07 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.107 -0.996 . . . . 0.0 109.055 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.68 88.89 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.232 -0.918 . . . . 0.0 109.04 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -55.66 -38.61 69.82 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.215 -0.928 . . . . 0.0 110.024 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.897 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.4 t -61.62 -38.76 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 121.176 -0.952 . . . . 0.0 109.662 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 12.8 mtmt -58.45 -45.24 88.96 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.053 -1.029 . . . . 0.0 109.395 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.92 -25.66 63.66 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.274 -0.891 . . . . 0.0 110.362 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -72.9 -50.78 21.62 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.84 -1.162 . . . . 0.0 110.583 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.516 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 37.6 p90 -99.85 34.88 2.15 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.994 -1.067 . . . . 0.0 111.464 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -38.96 14.22 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.769 -1.207 . . . . 0.0 109.871 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.42 32.02 6.07 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.268 -0.895 . . . . 0.0 110.663 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 17.4 t90 -85.39 -37.93 19.29 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.126 -0.984 . . . . 0.0 110.315 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.453 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.9 mtm -142.48 -67.36 0.38 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.103 -0.998 . . . . 0.0 110.206 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -156.98 38.82 0.31 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.095 -1.003 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 52.05 38.33 23.74 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.087 -1.008 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.37 74.8 1.55 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.104 -0.997 . . . . 0.0 110.2 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -154.83 73.44 0.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.199 -0.938 . . . . 0.0 110.687 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.45 35.15 4.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.947 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.4 t -109.86 -54.74 2.53 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.154 -0.966 . . . . 0.0 109.369 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.12 -20.01 64.97 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.282 -0.886 . . . . 0.0 111.365 179.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.812 HD12 HG11 ' A' ' 34' ' ' VAL . 50.0 mm -74.64 -41.09 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.698 -1.251 . . . . 0.0 109.914 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -67.29 -39.62 86.02 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.909 . . . . 0.0 110.146 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -56.3 -37.09 69.42 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.095 -1.003 . . . . 0.0 110.47 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.0 m . . . . . 0 N--CA 1.505 2.286 0 O-C-N 121.227 -0.921 . . . . 0.0 110.567 179.843 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 41.6 mttt . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.648 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.8 t80 -111.6 161.85 15.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.176 -0.953 . . . . 0.0 110.328 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -129.04 139.28 52.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.268 -0.895 . . . . 0.0 110.146 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -118.21 98.35 6.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.131 -0.981 . . . . 0.0 109.912 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.98 -36.05 48.47 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 121.033 -1.042 . . . . 0.0 110.75 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.817 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.2 m-85 -63.48 -30.92 71.96 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.036 -1.04 . . . . 0.0 110.254 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.0 m -99.46 -11.11 21.39 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.981 -1.075 . . . . 0.0 112.03 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t0 56.72 40.89 28.93 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.409 -1.432 . . . . 0.0 110.076 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -141.56 172.95 11.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.248 -0.907 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.5 t80 -119.92 128.41 53.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.304 -0.873 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.648 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.2 mp -82.27 169.75 16.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.2 -0.937 . . . . 0.0 109.732 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -97.43 -31.99 12.08 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.169 -0.957 . . . . 0.0 111.346 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 39.1 m-70 -116.04 137.6 51.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.91 -1.118 . . . . 0.0 110.126 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -114.19 96.44 5.8 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.209 -0.932 . . . . 0.0 109.838 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.36 177.96 1.61 Allowed Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.256 -0.902 . . . . 0.0 110.172 -179.707 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.02 -31.21 15.34 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.372 1.196 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.6 m -87.2 -39.76 15.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.912 -1.117 . . . . 0.0 110.084 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.433 HG11 ' O ' ' A' ' 15' ' ' HIS . 86.2 t -61.02 -47.81 91.9 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.226 -0.921 . . . . 0.0 109.716 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 20.5 mtt180 -57.53 -53.73 54.81 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.146 -0.972 . . . . 0.0 109.725 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -60.61 -40.08 90.54 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.191 -0.943 . . . . 0.0 109.009 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.1 m -56.22 -43.44 78.56 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.083 -1.011 . . . . 0.0 108.421 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.32 -36.87 81.34 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.028 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -97.48 49.38 1.04 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.146 -0.971 . . . . 0.0 110.389 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.82 37.76 3.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.12 -0.988 . . . . 0.0 110.284 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.61 129.51 4.02 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -54.42 -28.57 44.85 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.152 -1.205 . . . . 0.0 110.481 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -61.2 -35.16 76.43 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.996 -1.065 . . . . 0.0 110.503 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.491 ' O ' HG23 ' A' ' 34' ' ' VAL . 10.0 t-80 -51.68 -38.45 55.07 Favored 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.908 -1.12 . . . . 0.0 110.599 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -61.6 -55.74 27.41 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.114 -0.991 . . . . 0.0 109.245 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -58.97 -38.51 79.27 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.206 -0.934 . . . . 0.0 109.173 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.18 -38.33 70.79 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.163 -0.961 . . . . 0.0 110.128 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.854 ' CG1' HD12 ' A' ' 50' ' ' ILE . 98.2 t -63.52 -36.85 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.099 -1.001 . . . . 0.0 109.847 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -52.53 -40.58 62.62 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.007 -1.058 . . . . 0.0 109.821 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.71 -30.14 65.28 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.314 -0.866 . . . . 0.0 110.316 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.46 -53.48 19.03 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.885 -1.134 . . . . 0.0 109.946 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -100.11 34.39 2.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 111.198 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.77 -36.96 56.68 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 120.781 -1.199 . . . . 0.0 110.341 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.21 22.99 13.1 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.101 -0.999 . . . . 0.0 111.294 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.8 t90 -104.89 -49.46 3.49 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.865 -1.147 . . . . 0.0 110.238 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -103.54 -46.7 4.48 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.127 -0.983 . . . . 0.0 110.299 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 53.7 38.5 28.55 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.984 -1.073 . . . . 0.0 110.775 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -156.93 -65.82 0.1 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.634 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -164.69 77.68 0.33 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.18 -0.95 . . . . 0.0 110.788 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.54 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -122.84 73.7 1.16 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.166 -0.959 . . . . 0.0 110.431 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.1 35.9 4.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.284 -0.885 . . . . 0.0 110.388 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.0 m -111.21 -52.9 2.75 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.106 -0.996 . . . . 0.0 109.798 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.2 -21.3 61.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.134 -0.979 . . . . 0.0 111.551 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.854 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.4 mm -70.75 -38.61 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 120.719 -1.238 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -86.62 -39.97 15.6 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.106 -0.996 . . . . 0.0 110.065 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -64.27 -31.79 73.13 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.222 -0.924 . . . . 0.0 110.652 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.3 m . . . . . 0 N--CA 1.505 2.304 0 O-C-N 120.964 -1.085 . . . . 0.0 110.418 -179.901 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.2 mttp . . . . . 0 N--CA 1.501 2.116 0 CA-C-O 120.925 0.393 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -126.38 162.36 25.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.103 -0.998 . . . . 0.0 110.093 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -141.25 132.01 25.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -0.956 . . . . 0.0 110.393 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.4 t -110.63 88.87 2.88 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.203 -0.935 . . . . 0.0 109.553 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -50.96 -36.48 39.15 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.153 -0.967 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.975 ' CD2' HG13 ' A' ' 34' ' ' VAL . 26.6 m-85 -61.79 -30.55 70.89 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.041 -1.037 . . . . 0.0 110.127 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.0 m -98.15 -0.88 43.46 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.997 -1.064 . . . . 0.0 111.997 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 53.01 38.27 26.82 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.423 -1.423 . . . . 0.0 110.791 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.9 t -139.59 168.05 20.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.155 -0.966 . . . . 0.0 109.872 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -120.91 143.77 48.78 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.155 -0.966 . . . . 0.0 110.637 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.25 140.23 39.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -102.33 -21.03 14.38 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.074 -1.016 . . . . 0.0 112.441 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.555 ' CB ' HG21 ' A' ' 20' ' ' VAL . 40.0 m-70 -103.58 67.49 0.9 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.636 -1.29 . . . . 0.0 110.02 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.44 101.7 0.11 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.24 -0.912 . . . . 0.0 110.038 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.72 178.18 1.57 Allowed Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.026 -1.046 . . . . 0.0 110.251 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.88 -30.17 17.46 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.403 1.212 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 40.3 m -90.26 -40.77 11.96 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.888 -1.133 . . . . 0.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.555 HG21 ' CB ' ' A' ' 15' ' ' HIS . 98.1 t -59.6 -56.16 19.06 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.626 0 O-C-N 121.053 -1.029 . . . . 0.0 109.75 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.7 mtp85 -55.27 -50.28 69.92 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.072 -1.017 . . . . 0.0 109.899 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -62.34 -40.64 97.04 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.285 -0.966 . . . . 0.0 108.802 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 52.9 m -55.5 -43.08 75.32 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.097 -1.002 . . . . 0.0 108.368 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -64.73 -37.79 88.78 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.6 -0.84 . . . . 0.0 108.953 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -97.63 57.0 1.33 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.171 -0.956 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.13 37.73 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.129 -0.982 . . . . 0.0 110.443 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.13 122.69 1.25 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.84 -29.61 28.88 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.091 -1.241 . . . . 0.0 110.134 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -56.78 -31.99 65.21 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 33.9 t-80 -47.34 -38.64 13.29 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.132 -0.98 . . . . 0.0 111.306 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -55.06 26.74 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.006 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -59.49 -39.1 82.68 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.183 -0.948 . . . . 0.0 109.092 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -54.64 -36.38 64.47 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.194 -0.941 . . . . 0.0 110.261 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.975 HG13 ' CD2' ' A' ' 8' ' ' TYR . 89.1 t -55.34 -37.81 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.733 0 O-C-N 121.056 -1.027 . . . . 0.0 110.093 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 7.1 tttp -54.26 -39.67 67.07 Favored 'General case' 0 N--CA 1.514 2.737 0 O-C-N 121.073 -1.017 . . . . 0.0 109.894 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -59.8 -32.26 70.47 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.036 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 33.5 t80 -64.87 -52.17 58.06 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.954 -1.091 . . . . 0.0 110.169 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.535 ' HE2' HG12 ' A' ' 34' ' ' VAL . 49.3 p90 -100.38 34.69 2.31 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.097 -1.002 . . . . 0.0 111.15 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.6 14.56 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.736 -1.228 . . . . 0.0 109.788 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.36 34.47 4.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.247 -0.908 . . . . 0.0 110.415 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.486 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.7 t90 -93.5 -38.82 11.21 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.153 -0.967 . . . . 0.0 110.273 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.486 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.3 ttm -145.87 -62.19 0.33 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.177 -0.952 . . . . 0.0 110.392 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -143.35 -164.46 1.87 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.182 -0.949 . . . . 0.0 110.05 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.29 39.26 2.34 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.111 -0.993 . . . . 0.0 110.201 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -150.41 75.1 1.21 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.47 72.1 1.39 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.214 -0.928 . . . . 0.0 110.181 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.06 35.92 4.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.343 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -110.28 -54.94 2.52 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.147 -0.97 . . . . 0.0 109.309 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -21.06 64.12 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.204 -0.935 . . . . 0.0 111.208 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 34' ' ' VAL . 48.3 mm -74.36 -54.59 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.653 -1.28 . . . . 0.0 109.517 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -55.56 -39.67 70.94 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.14 -0.975 . . . . 0.0 110.3 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.7 tttt -59.74 -37.15 78.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.128 -0.983 . . . . 0.0 110.304 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 m . . . . . 0 N--CA 1.504 2.264 0 O-C-N 121.064 -1.022 . . . . 0.0 110.076 179.83 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 5.7 mttt . . . . . 0 N--CA 1.494 1.772 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.652 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.9 t80 -110.72 161.49 15.71 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.128 -0.983 . . . . 0.0 110.491 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 34.7 t80 -135.58 134.58 39.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.225 -0.922 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 39.3 t -114.27 96.67 5.91 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.125 -0.984 . . . . 0.0 110.1 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -53.52 -36.2 61.5 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.075 -1.016 . . . . 0.0 110.468 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.706 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -61.45 -32.76 72.75 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.138 -0.976 . . . . 0.0 110.074 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.9 m -96.51 -5.33 39.68 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.996 -1.065 . . . . 0.0 112.187 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 53.44 39.86 30.53 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.441 -1.412 . . . . 0.0 110.388 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -141.62 172.09 13.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.332 -0.855 . . . . 0.0 109.956 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.431 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 13.0 t80 -119.41 137.89 53.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.315 -0.866 . . . . 0.0 110.479 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.652 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.9 mp -96.59 168.29 10.62 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.237 -0.915 . . . . 0.0 109.587 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.513 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.2 t -98.88 -30.13 12.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.166 -0.958 . . . . 0.0 111.777 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.587 ' HB2' HG11 ' A' ' 20' ' ' VAL . 49.5 m-70 -113.06 148.73 34.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.909 -1.119 . . . . 0.0 110.413 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -126.56 96.88 4.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.338 -0.851 . . . . 0.0 109.678 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -150.46 178.5 1.49 Allowed Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.258 -0.901 . . . . 0.0 110.283 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.6 Cg_endo -70.43 -32.01 16.55 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.37 1.195 . . . . 0.0 110.897 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.2 m -86.07 -40.34 15.83 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 120.929 -1.107 . . . . 0.0 109.878 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 15' ' ' HIS . 77.8 t -61.94 -50.2 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.194 -0.941 . . . . 0.0 109.496 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.446 ' CD ' ' CE2' ' A' ' 4' ' ' PHE . 36.2 mtm-85 -57.45 -50.24 73.67 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.49 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.49 -40.91 96.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.139 -0.976 . . . . 0.0 108.674 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.1 m -54.57 -43.69 72.29 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.122 -0.987 . . . . 0.0 108.463 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -62.77 -39.99 95.89 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -93.07 55.75 2.4 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.267 -0.896 . . . . 0.0 110.35 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.89 37.29 4.25 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.063 -1.023 . . . . 0.0 110.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.87 126.95 2.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -28.3 42.98 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.126 -1.22 . . . . 0.0 110.462 179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -60.94 -32.4 71.92 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.972 -1.08 . . . . 0.0 110.708 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.553 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.22 -39.95 45.98 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.946 -1.096 . . . . 0.0 110.75 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 -52.81 60.1 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.071 -1.018 . . . . 0.0 108.89 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -61.26 -39.73 91.45 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.481 -0.888 . . . . 0.0 108.918 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -56.29 -38.56 71.39 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.237 -0.915 . . . . 0.0 109.981 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.706 HG13 ' CD2' ' A' ' 8' ' ' TYR . 73.5 t -56.84 -35.47 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.646 0 O-C-N 121.091 -1.005 . . . . 0.0 110.027 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.0 tttt -53.07 -42.82 66.22 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.999 -1.063 . . . . 0.0 109.935 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -57.51 -31.35 65.94 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.196 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -64.31 -51.3 64.13 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.991 -1.068 . . . . 0.0 110.148 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -100.37 33.62 2.63 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.152 -0.967 . . . . 0.0 111.352 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -91.16 -38.52 12.68 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.801 -1.187 . . . . 0.0 110.054 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -111.28 29.11 8.1 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.221 -0.924 . . . . 0.0 110.894 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.503 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 25.9 t90 -92.56 -40.07 11.0 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.002 -1.061 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.503 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.0 tpp -145.8 -60.4 0.33 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.073 -1.017 . . . . 0.0 110.286 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.32 -164.63 2.02 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.199 -0.938 . . . . 0.0 110.242 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -109.89 39.39 2.14 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.198 -0.939 . . . . 0.0 110.134 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -152.0 75.89 1.16 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.158 -0.964 . . . . 0.0 110.36 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -138.94 74.29 1.47 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.237 -0.914 . . . . 0.0 110.272 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -111.89 35.86 3.54 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.191 -0.943 . . . . 0.0 110.341 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.4 p -110.48 -53.78 2.65 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.172 -0.955 . . . . 0.0 109.547 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.31 63.3 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.252 -0.905 . . . . 0.0 111.322 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.653 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -73.27 -54.5 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 120.61 -1.306 . . . . 0.0 109.552 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -57.29 -39.49 75.83 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.185 -0.947 . . . . 0.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -63.85 -35.08 79.46 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.218 -0.926 . . . . 0.0 110.458 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.5 m . . . . . 0 N--CA 1.504 2.262 0 O-C-N 121.028 -1.045 . . . . 0.0 110.235 179.949 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.472 ' HD1' HD13 ' A' ' 13' ' ' LEU . 62.6 t80 -115.08 154.68 28.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.192 -0.943 . . . . 0.0 109.868 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 11' ' ' THR . 66.2 t80 -130.93 141.03 50.25 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.007 -1.058 . . . . 0.0 110.563 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.2 t -119.15 92.61 3.84 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.289 -0.882 . . . . 0.0 109.793 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -53.09 -36.48 60.75 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.093 -1.005 . . . . 0.0 111.064 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.791 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -62.15 -32.58 73.2 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 120.997 -1.064 . . . . 0.0 109.957 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 45.9 m -94.73 -1.33 53.2 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.989 -1.069 . . . . 0.0 111.934 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.88 38.27 28.34 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.304 -1.498 . . . . 0.0 110.439 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.406 ' O ' ' CD1' ' A' ' 5' ' ' TYR . 8.3 t -143.38 171.53 14.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.164 -0.96 . . . . 0.0 110.011 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.7 OUTLIER -129.86 131.26 46.04 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 109.954 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.472 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.5 mp -87.99 161.67 17.27 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.117 -0.989 . . . . 0.0 110.145 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -97.22 -29.98 13.26 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.998 -1.064 . . . . 0.0 111.6 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.428 ' HB2' HG11 ' A' ' 20' ' ' VAL . 47.9 m-70 -106.88 130.77 54.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.903 -1.123 . . . . 0.0 109.974 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -114.18 76.89 1.01 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.165 -0.959 . . . . 0.0 110.002 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -119.87 -179.11 0.65 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.278 -0.889 . . . . 0.0 109.934 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.9 Cg_endo -72.83 -26.56 15.6 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.292 1.154 . . . . 0.0 111.507 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.1 t -92.06 -42.71 9.81 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.752 -1.218 . . . . 0.0 110.196 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 15' ' ' HIS . 81.4 t -57.82 -53.12 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.018 . . . . 0.0 109.932 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 mtp180 -55.98 -51.12 68.84 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.023 -1.048 . . . . 0.0 109.809 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -61.98 -40.8 96.85 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.143 -0.973 . . . . 0.0 108.728 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -54.64 -43.03 71.96 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.215 -0.928 . . . . 0.0 108.504 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -62.88 -37.8 88.34 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 119.627 -0.829 . . . . 0.0 108.979 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -97.26 51.39 1.1 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.224 -0.922 . . . . 0.0 110.2 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.32 37.99 3.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.355 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.4 127.76 2.84 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.52 -28.33 44.57 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.205 -1.173 . . . . 0.0 110.496 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -61.12 -33.15 72.92 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.88 -1.138 . . . . 0.0 110.669 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.6 t-80 -50.33 -41.34 51.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.933 -1.105 . . . . 0.0 110.87 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -61.79 -56.08 23.27 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.236 179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -59.0 -38.02 78.23 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.159 -0.963 . . . . 0.0 109.157 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -56.35 -39.35 72.73 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.113 -0.992 . . . . 0.0 110.041 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.791 HG13 ' CD1' ' A' ' 8' ' ' TYR . 84.2 t -62.86 -39.28 84.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 109.544 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -59.59 -42.45 92.6 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.058 -1.026 . . . . 0.0 109.215 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.42 -31.48 69.31 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.062 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -69.85 -51.73 30.97 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.922 -1.111 . . . . 0.0 110.249 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.718 ' HE2' HG12 ' A' ' 34' ' ' VAL . 42.3 p90 -99.88 33.89 2.44 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.073 -1.017 . . . . 0.0 111.34 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -39.73 17.46 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.78 -1.2 . . . . 0.0 109.874 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -90.34 -29.65 17.94 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.25 -0.906 . . . . 0.0 110.372 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.1 t90 -46.6 -33.89 4.53 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.086 -1.009 . . . . 0.0 111.788 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.454 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.5 mtt -151.77 -55.22 0.14 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.992 -1.068 . . . . 0.0 111.198 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 59.26 40.08 21.82 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.902 -1.124 . . . . 0.0 110.027 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -147.41 85.91 1.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.224 -0.922 . . . . 0.0 110.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 53.55 74.22 0.33 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.001 -1.062 . . . . 0.0 110.635 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -143.4 69.45 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.21 -0.931 . . . . 0.0 110.207 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -129.95 32.75 4.5 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 0.0 110.634 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.6 m -102.89 -48.21 4.14 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.055 -1.028 . . . . 0.0 109.605 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -21.64 61.84 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.184 -0.948 . . . . 0.0 111.42 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.785 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -83.47 -40.84 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.368 0 O-C-N 120.601 -1.312 . . . . 0.0 109.938 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.72 -40.35 83.47 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.168 -0.958 . . . . 0.0 110.09 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.31 -35.51 67.62 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.581 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.1 m . . . . . 0 N--CA 1.504 2.263 0 O-C-N 121.047 -1.033 . . . . 0.0 110.531 179.793 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.5 mttt . . . . . 0 N--CA 1.495 1.816 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 47.8 t80 -111.1 157.08 20.42 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.131 -0.981 . . . . 0.0 110.144 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -129.72 137.88 50.82 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.201 -0.937 . . . . 0.0 110.31 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.9 t -115.59 96.36 5.59 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.206 -0.934 . . . . 0.0 110.223 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -54.02 -36.35 62.9 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.057 -1.027 . . . . 0.0 110.341 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.778 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.7 m-85 -60.26 -33.97 73.07 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.071 -1.018 . . . . 0.0 110.039 179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' HG22 ' A' ' 11' ' ' THR . 38.0 m -94.73 0.88 55.36 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.118 -0.989 . . . . 0.0 112.036 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.49 37.56 19.76 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.468 -1.395 . . . . 0.0 110.797 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.413 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.1 t -146.26 171.26 15.22 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.24 -0.913 . . . . 0.0 110.173 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.17 124.55 47.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.043 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.413 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.5 mp -73.41 167.15 21.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.228 -0.92 . . . . 0.0 109.668 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.413 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.0 t -101.12 -28.46 12.68 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.139 -0.976 . . . . 0.0 111.951 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.691 ' HB2' HG11 ' A' ' 20' ' ' VAL . 40.6 m-70 -111.22 144.67 40.0 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.726 -1.234 . . . . 0.0 110.167 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -123.09 92.58 3.73 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 109.887 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -141.82 178.26 1.59 Allowed Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.243 -0.911 . . . . 0.0 110.047 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.43 -30.81 14.8 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.465 1.245 . . . . 0.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 t -89.96 -40.5 12.32 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.947 -1.096 . . . . 0.0 109.991 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.3 t -58.96 -53.17 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.125 -0.985 . . . . 0.0 109.787 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 32.9 mtm180 -56.81 -51.57 68.46 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.075 -1.016 . . . . 0.0 109.735 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -61.82 -40.17 94.34 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.286 -0.966 . . . . 0.0 108.968 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.4 -42.61 74.29 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.053 -1.029 . . . . 0.0 108.482 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.93 -36.35 83.14 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.348 -0.845 . . . . 0.0 109.172 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.69 46.37 0.97 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.172 -0.955 . . . . 0.0 110.448 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.58 38.51 3.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.108 -0.995 . . . . 0.0 110.199 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.34 126.49 2.6 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -28.27 45.41 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.185 -1.186 . . . . 0.0 110.287 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -58.35 -33.95 70.11 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.894 -1.128 . . . . 0.0 110.479 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.45 -37.65 39.41 Favored 'General case' 0 N--CA 1.516 2.834 0 O-C-N 120.963 -1.086 . . . . 0.0 110.733 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -55.56 28.58 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.027 -1.046 . . . . 0.0 109.126 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.19 -39.25 82.01 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.238 -0.914 . . . . 0.0 109.179 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.53 -37.43 70.45 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.218 -0.926 . . . . 0.0 110.072 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.778 HG13 ' CD2' ' A' ' 8' ' ' TYR . 87.2 t -57.9 -37.67 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.023 -1.048 . . . . 0.0 109.944 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 21.0 tttp -54.32 -40.43 67.95 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.947 -1.095 . . . . 0.0 109.669 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -58.37 -28.97 65.63 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.24 -0.913 . . . . 0.0 110.276 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -70.93 -54.32 11.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.882 -1.136 . . . . 0.0 109.996 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.6 p90 -99.01 27.77 4.82 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.159 -0.963 . . . . 0.0 111.536 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -62.92 -36.8 84.57 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.699 -1.251 . . . . 0.0 110.381 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -109.29 28.51 8.44 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.192 -0.942 . . . . 0.0 111.019 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.47 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 18.6 t90 -103.42 -49.77 3.62 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.089 -1.007 . . . . 0.0 110.041 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.47 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 1.3 ttm -148.94 -57.51 0.21 Allowed 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.203 -0.935 . . . . 0.0 110.413 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 55.03 -165.51 0.11 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.924 -1.11 . . . . 0.0 110.388 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 53.41 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.036 -1.04 . . . . 0.0 110.371 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 55.49 69.92 0.69 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.979 -1.076 . . . . 0.0 110.338 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.82 69.05 1.07 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.239 -0.913 . . . . 0.0 110.375 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -131.6 33.0 4.07 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.285 -0.884 . . . . 0.0 110.71 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.8 p -103.76 -49.9 3.54 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.097 -1.002 . . . . 0.0 109.389 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.15 -21.11 63.46 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.24 -0.912 . . . . 0.0 111.319 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.718 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -82.8 -40.15 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 120.723 -1.236 . . . . 0.0 109.951 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -76.58 -40.7 48.8 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -57.07 -33.33 67.16 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.076 -1.015 . . . . 0.0 110.652 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 78.0 m . . . . . 0 N--CA 1.503 2.221 0 O-C-N 120.968 -1.082 . . . . 0.0 110.34 -179.979 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.406 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 9.3 mtmm . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.53 ' HD2' HD13 ' A' ' 13' ' ' LEU . 89.6 t80 -107.08 161.54 14.66 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.225 -0.922 . . . . 0.0 109.992 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -137.76 137.36 38.19 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.114 -0.991 . . . . 0.0 110.222 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 t -120.71 92.84 3.86 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.258 -0.901 . . . . 0.0 110.043 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -52.7 -36.16 56.85 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.041 -1.037 . . . . 0.0 110.424 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.906 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.6 m-85 -60.13 -33.81 72.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.087 -1.008 . . . . 0.0 110.01 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.8 m -94.21 -2.54 52.34 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.101 -0.999 . . . . 0.0 112.129 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.57 40.45 31.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.38 -1.45 . . . . 0.0 110.554 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.8 t -145.93 169.95 17.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.246 -0.909 . . . . 0.0 110.328 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.406 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 23.6 t80 -120.86 140.58 51.58 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.166 -0.959 . . . . 0.0 110.688 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.53 HD13 ' HD2' ' A' ' 4' ' ' PHE . 6.2 mp -97.04 164.42 12.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.587 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.9 t -101.48 -21.83 14.68 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.127 -0.983 . . . . 0.0 112.319 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.587 ' CD2' HG23 ' A' ' 14' ' ' THR . 52.9 m-70 -121.83 137.33 54.82 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.596 -1.315 . . . . 0.0 110.198 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -116.09 88.28 2.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.184 -0.947 . . . . 0.0 109.845 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -132.5 178.54 1.71 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.265 -0.897 . . . . 0.0 109.898 -179.617 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -70.88 -28.27 20.09 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.39 1.205 . . . . 0.0 111.285 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.5 m -91.99 -43.17 9.59 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.891 -1.131 . . . . 0.0 110.125 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.461 HG11 ' HB2' ' A' ' 15' ' ' HIS . 87.8 t -58.58 -53.34 48.19 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.091 -1.006 . . . . 0.0 109.905 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 4' ' ' PHE . 34.8 mtp180 -56.98 -50.0 74.01 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.034 -1.041 . . . . 0.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -40.53 96.62 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.122 -0.986 . . . . 0.0 108.692 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.7 m -54.0 -43.02 69.68 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.136 -0.977 . . . . 0.0 108.429 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.3 -38.65 91.98 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 119.565 -0.854 . . . . 0.0 108.822 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -98.57 47.36 0.99 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.206 -0.934 . . . . 0.0 110.466 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -115.37 40.13 2.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.14 -0.975 . . . . 0.0 109.887 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.68 147.86 19.43 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -76.88 -10.42 59.36 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.258 -1.142 . . . . 0.0 111.22 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -88.36 -26.09 22.39 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.652 -1.28 . . . . 0.0 111.079 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.421 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.2 t-80 -49.21 -40.16 32.5 Favored 'General case' 0 N--CA 1.518 2.949 0 O-C-N 120.814 -1.179 . . . . 0.0 110.903 -179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -62.72 -55.62 25.03 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.104 -0.998 . . . . 0.0 109.101 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.86 -38.65 82.73 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.208 -0.932 . . . . 0.0 109.124 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -56.62 -37.28 70.5 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.14 -0.975 . . . . 0.0 110.094 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.906 HG13 ' CD1' ' A' ' 8' ' ' TYR . 47.9 t -55.97 -36.52 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.029 -1.044 . . . . 0.0 109.993 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.4 ttpm? -55.38 -41.1 72.18 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 120.899 -1.125 . . . . 0.0 109.751 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -58.51 -26.05 63.06 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.308 -0.87 . . . . 0.0 110.552 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -73.64 -52.41 13.46 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.819 -1.176 . . . . 0.0 110.438 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.469 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 36.9 p90 -99.08 30.79 3.27 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.036 -1.04 . . . . 0.0 111.517 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -73.98 -41.45 61.9 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.668 -1.27 . . . . 0.0 109.692 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.09 22.85 11.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.314 -0.866 . . . . 0.0 111.117 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.458 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 24.9 t90 -56.41 -48.84 76.11 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.806 -1.184 . . . . 0.0 110.276 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.458 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -139.58 34.74 2.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.933 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 50.19 37.58 15.09 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.926 -1.109 . . . . 0.0 111.02 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -143.65 -172.84 3.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 110.279 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -109.12 114.25 27.81 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -113.92 76.59 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.286 -0.884 . . . . 0.0 110.216 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -108.85 36.37 2.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.168 -0.958 . . . . 0.0 110.371 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.29 -56.08 2.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.204 -0.935 . . . . 0.0 109.424 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.89 64.42 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.196 -0.94 . . . . 0.0 111.254 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.763 HD12 HG11 ' A' ' 34' ' ' VAL . 46.6 mm -69.35 -41.35 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.629 -1.294 . . . . 0.0 109.509 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.08 -39.05 56.21 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.281 -0.887 . . . . 0.0 110.007 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.62 -34.54 72.22 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.158 -0.964 . . . . 0.0 110.529 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.5 m . . . . . 0 N--CA 1.505 2.321 0 O-C-N 121.024 -1.048 . . . . 0.0 110.223 179.933 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt . . . . . 0 N--CA 1.503 2.221 0 CA-C-O 121.029 0.442 . . . . 0.0 110.813 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.669 ' HD1' HD13 ' A' ' 13' ' ' LEU . 88.2 t80 -116.72 162.16 18.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.993 -1.067 . . . . 0.0 110.353 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -135.9 133.84 38.11 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -113.52 95.53 5.4 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.143 -0.973 . . . . 0.0 110.275 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -52.87 -35.94 58.42 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.065 -1.022 . . . . 0.0 110.34 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.548 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.2 m-85 -60.74 -31.99 71.29 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.136 -0.977 . . . . 0.0 110.11 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.9 m -98.59 -4.96 32.88 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.005 -1.059 . . . . 0.0 112.255 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 t0 54.14 39.59 30.85 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.46 -1.4 . . . . 0.0 110.337 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -142.16 172.96 11.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.195 -0.941 . . . . 0.0 110.032 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -120.03 135.44 54.93 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.262 -0.898 . . . . 0.0 110.594 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.669 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.2 mp -95.43 165.38 12.39 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.166 -0.959 . . . . 0.0 109.442 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.526 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.2 t -99.48 -22.16 15.62 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.063 -1.023 . . . . 0.0 112.031 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.775 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.1 m-70 -117.17 145.95 43.51 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.721 -1.237 . . . . 0.0 110.282 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -127.81 92.85 3.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 109.569 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.455 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.81 178.93 1.28 Allowed Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.325 -0.86 . . . . 0.0 110.116 -179.529 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -70.53 -26.71 23.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.377 1.198 . . . . 0.0 111.108 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 m -92.66 -41.73 10.02 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.81 -1.181 . . . . 0.0 109.929 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.775 HG11 ' HB2' ' A' ' 15' ' ' HIS . 67.5 t -60.97 -52.49 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.128 -0.983 . . . . 0.0 109.602 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 -56.4 -50.37 71.82 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.053 -1.029 . . . . 0.0 109.558 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.25 -41.28 98.3 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.359 -0.936 . . . . 0.0 108.573 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 57.9 m -54.25 -43.68 71.12 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.081 -1.012 . . . . 0.0 108.445 178.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -62.22 -38.68 90.11 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.407 -0.808 . . . . 0.0 108.832 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -95.84 51.89 1.29 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.155 -0.966 . . . . 0.0 110.336 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.35 37.72 4.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.098 -1.001 . . . . 0.0 110.257 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.79 128.38 3.44 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 ttt-85 -53.83 -28.83 37.98 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.523 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -59.84 -36.35 76.67 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.925 -1.109 . . . . 0.0 110.349 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.599 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -52.16 -40.23 61.13 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.967 -1.083 . . . . 0.0 110.371 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -63.42 -55.05 27.42 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.181 -0.949 . . . . 0.0 109.069 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -60.25 -38.9 84.93 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.245 -0.909 . . . . 0.0 109.098 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -57.12 -38.84 74.02 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.156 -0.965 . . . . 0.0 109.849 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.924 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -60.15 -38.6 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.126 -0.984 . . . . 0.0 109.721 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -56.5 -49.24 75.3 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.988 -1.07 . . . . 0.0 109.445 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.72 -27.58 59.45 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.317 -0.865 . . . . 0.0 110.49 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -74.38 -50.59 17.98 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.904 -1.122 . . . . 0.0 110.548 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.658 ' CE2' HG12 ' A' ' 34' ' ' VAL . 38.5 p90 -99.53 34.43 2.22 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.016 -1.052 . . . . 0.0 111.552 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.4 tp60 -83.85 -40.47 18.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.726 -1.234 . . . . 0.0 109.824 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -115.02 29.43 8.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.264 -0.898 . . . . 0.0 110.83 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CE2' ' HE2' ' A' ' 42' ' ' MET . 12.3 t90 -51.27 -53.68 33.22 Favored 'General case' 0 N--CA 1.513 2.718 0 O-C-N 120.946 -1.096 . . . . 0.0 110.873 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CE2' ' A' ' 41' ' ' TRP . 19.6 mtm -144.7 -71.1 0.28 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.0 110.448 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -172.64 45.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.928 -1.107 . . . . 0.0 111.126 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -165.31 -168.19 1.32 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.124 -0.985 . . . . 0.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -115.47 126.63 54.55 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.208 -0.933 . . . . 0.0 110.074 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -116.34 74.74 0.92 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.03 35.81 3.11 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.047 -1.033 . . . . 0.0 110.395 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -112.09 -53.56 2.7 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.148 -0.97 . . . . 0.0 109.843 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -20.85 63.4 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.188 -0.945 . . . . 0.0 111.545 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.924 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -69.51 -47.61 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.677 -1.265 . . . . 0.0 109.58 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.5 -38.53 77.85 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.121 -0.987 . . . . 0.0 110.245 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -70.87 -35.31 72.32 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.13 -0.981 . . . . 0.0 110.417 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m . . . . . 0 N--CA 1.505 2.317 0 O-C-N 121.004 -1.06 . . . . 0.0 110.174 179.859 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.2 mttm . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE2' ' NH2' ' A' ' 21' ' ' ARG . 37.2 t80 -115.85 156.2 26.53 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.189 -0.944 . . . . 0.0 109.912 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -140.52 140.5 35.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.156 -0.965 . . . . 0.0 110.442 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 t -113.17 98.54 7.2 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.251 -0.905 . . . . 0.0 109.99 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -56.47 -36.55 69.21 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.204 -0.935 . . . . 0.0 110.693 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 24.6 m-85 -62.5 -34.5 76.98 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.047 -1.033 . . . . 0.0 110.064 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.9 m -93.41 -3.18 53.67 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.055 -1.028 . . . . 0.0 112.004 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 53.98 38.73 29.48 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.4 -1.438 . . . . 0.0 110.457 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -134.66 171.68 14.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.265 -0.897 . . . . 0.0 109.86 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.09 120.54 32.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -83.0 162.05 21.56 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.12 -0.987 . . . . 0.0 109.493 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.516 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -101.09 -31.04 11.26 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.086 -1.009 . . . . 0.0 111.848 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.516 ' CD2' HG23 ' A' ' 14' ' ' THR . 42.4 m-70 -115.23 137.6 51.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.796 -1.19 . . . . 0.0 110.427 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -116.27 89.41 3.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.252 -0.905 . . . . 0.0 109.765 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -131.63 -179.99 1.2 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.857 . . . . 0.0 109.923 -179.568 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.33 -28.92 17.67 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.419 1.221 . . . . 0.0 111.093 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 t -92.27 -44.25 8.85 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.889 -1.132 . . . . 0.0 110.019 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.486 HG11 ' HB2' ' A' ' 15' ' ' HIS . 98.0 t -59.03 -52.23 63.16 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.052 -1.03 . . . . 0.0 109.825 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.449 ' NH2' ' CE2' ' A' ' 4' ' ' PHE . 24.9 mtp85 -58.49 -50.25 74.43 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.031 -1.043 . . . . 0.0 109.552 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -61.27 -39.9 92.12 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.186 -0.946 . . . . 0.0 108.881 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.5 m -54.03 -42.23 68.92 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.149 -0.969 . . . . 0.0 108.681 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.61 -39.58 94.74 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.2 t -93.9 57.3 2.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.304 -0.873 . . . . 0.0 110.084 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.5 m -113.06 37.87 3.01 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.104 -0.998 . . . . 0.0 110.557 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.28 126.55 1.99 Allowed Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.096 -1.201 . . . . 0.0 110.096 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -55.08 -28.19 50.54 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.058 -1.26 . . . . 0.0 110.165 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -57.8 -33.9 69.06 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.888 -1.133 . . . . 0.0 110.394 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.4 t-80 -49.45 -43.94 45.24 Favored 'General case' 0 N--CA 1.515 2.812 0 O-C-N 120.991 -1.068 . . . . 0.0 110.86 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.9 tttt -60.79 -54.08 49.55 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.061 -1.024 . . . . 0.0 109.185 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -60.03 -38.44 82.73 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.211 -0.931 . . . . 0.0 109.088 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -56.51 -37.17 70.06 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.173 -0.954 . . . . 0.0 110.198 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 84.0 t -61.91 -37.34 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 121.082 -1.011 . . . . 0.0 110.066 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.3 mtpt -54.24 -41.78 69.14 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.901 -1.124 . . . . 0.0 109.73 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.91 -28.89 66.62 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.291 178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -71.18 -52.16 20.75 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.924 -1.11 . . . . 0.0 110.285 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.52 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 37.9 p90 -100.09 35.8 1.99 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.079 -1.013 . . . . 0.0 111.263 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -37.9 14.28 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.85 -1.156 . . . . 0.0 110.151 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -112.87 27.82 9.31 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 111.165 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.426 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.0 t90 -70.18 -43.08 71.51 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.029 -1.045 . . . . 0.0 110.019 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.426 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -151.66 36.32 0.57 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.219 -0.926 . . . . 0.0 110.746 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 50.54 38.77 19.47 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.961 -1.087 . . . . 0.0 111.088 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -140.84 -173.94 3.85 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.139 -0.976 . . . . 0.0 110.304 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -112.77 116.69 30.48 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.52 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -115.77 73.47 0.84 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.201 -0.937 . . . . 0.0 110.221 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.74 36.76 2.32 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.082 -1.011 . . . . 0.0 110.205 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.8 p -113.08 -55.63 2.5 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.118 -0.989 . . . . 0.0 109.452 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -21.65 64.33 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.183 -0.948 . . . . 0.0 111.161 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HG11 ' A' ' 34' ' ' VAL . 44.3 mm -66.79 -41.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.618 -1.301 . . . . 0.0 109.219 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -61.17 -41.73 97.3 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.606 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -59.97 -36.49 77.22 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.189 -0.944 . . . . 0.0 110.14 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.505 2.309 0 O-C-N 121.041 -1.037 . . . . 0.0 109.998 179.789 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 mttm . . . . . 0 N--CA 1.506 2.325 0 CA-C-O 121.069 0.462 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.495 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.0 t80 -103.83 161.18 14.17 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.948 -1.095 . . . . 0.0 110.192 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -133.39 137.27 45.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.167 -0.958 . . . . 0.0 110.435 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.6 t -113.69 98.96 7.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.303 -0.873 . . . . 0.0 110.077 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -56.48 -36.83 69.55 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.105 -0.997 . . . . 0.0 110.256 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.8 m-85 -59.7 -33.42 71.58 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.402 ' CB ' HG22 ' A' ' 11' ' ' THR . 39.1 m -95.56 0.15 52.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.016 -1.052 . . . . 0.0 112.112 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 51.92 37.78 21.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.398 -1.439 . . . . 0.0 110.741 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.402 HG22 ' CB ' ' A' ' 9' ' ' CYS . 8.3 t -144.24 171.75 13.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.233 -0.917 . . . . 0.0 109.892 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.38 125.27 47.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 110.206 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.3 mp -74.7 170.29 16.13 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.155 -0.966 . . . . 0.0 109.704 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.509 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -100.3 -31.8 11.17 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.217 -0.927 . . . . 0.0 111.681 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CD2' HG23 ' A' ' 14' ' ' THR . 37.1 m-70 -116.54 142.21 47.17 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.83 -1.169 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -117.79 93.69 4.24 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 109.857 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.05 177.94 1.9 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 110.12 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.96 -31.11 15.69 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.426 1.224 . . . . 0.0 110.954 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -41.77 11.21 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.021 -1.049 . . . . 0.0 110.002 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.494 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.2 t -59.31 -54.29 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 109.911 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 14.8 mtp-105 -56.56 -49.87 73.58 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.102 -0.999 . . . . 0.0 109.907 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -40.47 97.65 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.163 -1.015 . . . . 0.0 108.794 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 55.8 m -54.74 -42.68 71.9 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.08 -1.013 . . . . 0.0 108.423 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -62.36 -35.76 80.12 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.256 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -100.62 42.8 1.09 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.096 -1.003 . . . . 0.0 110.479 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -115.34 38.42 3.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.203 -0.936 . . . . 0.0 110.213 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.75 128.37 3.45 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -54.11 -28.7 41.29 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.227 -1.161 . . . . 0.0 110.359 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -59.24 -35.38 73.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.973 -1.079 . . . . 0.0 110.397 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.558 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.6 t-80 -51.83 -39.04 58.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.91 -1.119 . . . . 0.0 110.473 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -62.19 -53.7 51.55 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.092 -1.005 . . . . 0.0 109.037 179.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -60.63 -39.22 87.42 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.037 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -56.26 -38.74 71.55 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.806 HG11 HD12 ' A' ' 50' ' ' ILE . 79.0 t -58.89 -38.95 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.55 0 O-C-N 121.042 -1.036 . . . . 0.0 109.597 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 1.2 tmmt? -54.47 -39.97 67.98 Favored 'General case' 0 N--CA 1.513 2.705 0 O-C-N 121.028 -1.045 . . . . 0.0 109.618 179.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.75 -33.14 69.94 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.37 -53.65 45.25 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.033 -1.042 . . . . 0.0 109.621 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.564 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.9 p90 -100.73 35.29 2.2 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.203 -0.936 . . . . 0.0 110.922 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.45 -35.91 53.48 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.753 -1.217 . . . . 0.0 110.293 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -102.27 21.21 15.39 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.063 -1.023 . . . . 0.0 111.402 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.466 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.2 t90 -106.93 -52.8 2.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.88 -1.138 . . . . 0.0 109.827 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.669 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 2.7 mtm -142.03 54.46 1.47 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.28 -0.888 . . . . 0.0 109.817 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -50.27 -34.99 25.25 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.121 -0.987 . . . . 0.0 111.272 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.2 -61.96 1.94 Allowed 'General case' 0 N--CA 1.513 2.705 0 O-C-N 120.937 -1.102 . . . . 0.0 110.585 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -147.75 96.62 2.7 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.423 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.669 ' HB2' ' HB3' ' A' ' 42' ' ' MET . . . -145.79 71.51 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.229 -0.919 . . . . 0.0 110.486 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 35.15 2.33 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.15 -0.969 . . . . 0.0 110.482 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.02 -52.88 2.71 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.061 -1.024 . . . . 0.0 109.578 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -20.93 64.1 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.262 -0.898 . . . . 0.0 111.334 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.806 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -75.13 -39.99 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 120.622 -1.299 . . . . 0.0 109.847 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -75.76 -40.38 55.47 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.095 -1.003 . . . . 0.0 110.004 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.4 mtpt -57.42 -34.74 69.24 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.164 -0.96 . . . . 0.0 110.635 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.7 m . . . . . 0 N--CA 1.504 2.243 0 O-C-N 121.021 -1.05 . . . . 0.0 110.247 179.858 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.454 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 42.8 mttt . . . . . 0 N--CA 1.494 1.743 0 N-CA-C 110.275 -0.269 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 90.2 t80 -109.65 161.98 14.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.167 -179.774 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -129.36 138.24 51.42 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.113 -0.992 . . . . 0.0 110.37 -179.873 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 47.4 t -117.11 96.77 5.59 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.17 -0.956 . . . . 0.0 109.967 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -51.88 -35.98 47.03 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.021 -1.05 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.708 ' CD1' HG13 ' A' ' 34' ' ' VAL . 76.9 m-85 -62.81 -31.19 72.13 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.186 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.449 ' HB3' HG22 ' A' ' 11' ' ' THR . 36.0 m -98.02 -9.45 26.02 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.008 -1.058 . . . . 0.0 111.965 179.786 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.1 t70 56.34 41.22 29.33 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.382 -1.449 . . . . 0.0 110.014 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.449 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.9 t -146.21 174.26 11.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.281 -0.887 . . . . 0.0 110.191 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.454 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.68 138.84 51.73 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.3 -0.875 . . . . 0.0 110.623 -179.686 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.4 mp -93.79 171.31 8.95 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.137 -0.977 . . . . 0.0 109.735 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -96.67 -30.2 13.38 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.26 -0.9 . . . . 0.0 111.368 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.719 ' HB2' HG11 ' A' ' 20' ' ' VAL . 49.6 m-70 -113.21 148.26 35.84 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.823 -1.173 . . . . 0.0 110.188 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -126.65 96.3 4.62 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.255 -0.903 . . . . 0.0 109.845 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -152.23 178.1 1.68 Allowed Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.234 -0.916 . . . . 0.0 110.456 -179.712 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.0 Cg_endo -70.72 -33.64 12.63 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.296 1.156 . . . . 0.0 110.74 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.7 m -84.65 -37.09 21.47 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.007 -1.058 . . . . 0.0 110.142 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.719 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.9 t -64.51 -45.81 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.084 -1.01 . . . . 0.0 109.438 179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -57.27 -50.77 71.84 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.992 -1.067 . . . . 0.0 109.571 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.65 -41.4 97.46 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.69 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.4 m -54.6 -43.43 72.15 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.18 -0.95 . . . . 0.0 108.612 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.435 ' ND1' HD21 ' A' ' 13' ' ' LEU . 75.4 t60 -61.13 -37.61 83.41 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.452 -0.78 . . . . 0.0 109.109 178.081 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.5 t -94.21 54.65 1.91 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.119 -0.988 . . . . 0.0 110.386 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.12 38.98 3.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.087 -1.008 . . . . 0.0 110.049 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.59 163.43 23.25 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -88.96 -12.49 41.42 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.323 -1.104 . . . . 0.0 110.901 178.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.1 mmtm -91.11 -26.64 19.03 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.634 -1.291 . . . . 0.0 111.177 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.549 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.3 t-80 -49.37 -38.66 29.3 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.836 -1.165 . . . . 0.0 110.751 -179.695 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -64.83 -53.44 46.77 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.216 -0.994 . . . . 0.0 108.981 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -61.09 -39.5 90.17 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.181 -0.949 . . . . 0.0 109.028 178.553 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -56.27 -37.98 70.56 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.137 -0.977 . . . . 0.0 110.055 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.708 HG13 ' CD1' ' A' ' 8' ' ' TYR . 64.4 t -59.74 -38.28 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 O-C-N 121.113 -0.992 . . . . 0.0 109.84 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -55.11 -40.69 70.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.912 -1.118 . . . . 0.0 109.782 179.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -58.36 -32.14 68.28 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.303 -0.873 . . . . 0.0 110.133 179.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -65.31 -52.84 51.44 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.965 -1.085 . . . . 0.0 110.116 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.599 ' HE2' HG12 ' A' ' 34' ' ' VAL . 47.9 p90 -100.55 35.5 2.12 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.082 -1.011 . . . . 0.0 111.061 179.611 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -81.63 -37.73 27.08 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.727 -1.233 . . . . 0.0 110.297 179.205 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -112.73 21.42 15.57 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.207 -0.933 . . . . 0.0 111.587 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 17.8 t90 -61.08 -46.49 90.45 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.809 -1.182 . . . . 0.0 109.858 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.6 mtm -152.65 36.24 0.5 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.211 -0.93 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.65 46.47 25.67 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.939 -1.101 . . . . 0.0 111.055 179.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -146.33 -172.3 3.92 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.107 -0.996 . . . . 0.0 110.374 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -110.86 162.95 14.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.155 -0.966 . . . . 0.0 109.999 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -168.75 77.57 0.12 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.167 -0.958 . . . . 0.0 111.164 -179.748 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -109.85 34.5 3.81 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.058 -1.026 . . . . 0.0 110.433 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.03 -57.71 2.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.182 -0.949 . . . . 0.0 109.101 179.251 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 pp -54.33 -26.34 29.1 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.195 -0.941 . . . . 0.0 111.271 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.638 HD12 HG11 ' A' ' 34' ' ' VAL . 41.5 mm -61.15 -41.51 89.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 120.646 -1.284 . . . . 0.0 109.483 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -36.29 79.53 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.229 -0.919 . . . . 0.0 110.753 -179.62 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.51 -39.61 11.84 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.059 -1.026 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.508 2.427 0 O-C-N 121.154 -0.966 . . . . 0.0 110.091 -179.878 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.445 ' HE3' ' OG1' ' A' ' 14' ' ' THR . 23.8 mttp . . . . . 0 N--CA 1.495 1.813 0 CA-C-O 120.69 0.281 . . . . 0.0 110.413 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.445 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 43.1 t80 -110.21 156.04 21.19 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.202 -0.936 . . . . 0.0 109.886 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -138.38 136.8 36.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.608 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 t -110.6 93.45 4.5 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.2 -0.938 . . . . 0.0 110.089 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -52.23 -36.23 51.82 Favored 'General case' 0 N--CA 1.513 2.703 0 O-C-N 121.072 -1.017 . . . . 0.0 110.515 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.863 ' CD1' HG13 ' A' ' 34' ' ' VAL . 87.5 m-85 -60.34 -32.58 71.39 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.133 -0.98 . . . . 0.0 110.025 178.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.1 m -97.45 -0.52 46.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.057 -1.027 . . . . 0.0 112.162 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 t70 52.73 38.93 27.62 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.383 -1.448 . . . . 0.0 110.599 -179.709 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -137.56 172.76 12.49 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.286 -0.884 . . . . 0.0 110.021 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.0 120.17 32.57 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.31 -0.869 . . . . 0.0 110.131 -179.759 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -82.17 146.34 29.61 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.193 -0.942 . . . . 0.0 109.612 179.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.445 ' OG1' ' HE3' ' A' ' 3' ' ' LYS . 14.1 t -104.06 -20.55 13.81 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.073 -1.017 . . . . 0.0 112.62 -179.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.532 ' HB2' HG11 ' A' ' 20' ' ' VAL . 27.7 m-70 -106.16 70.44 0.84 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.587 -1.32 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -61.11 101.78 0.17 Allowed 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.197 -0.939 . . . . 0.0 109.874 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.22 176.63 2.12 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.022 -1.049 . . . . 0.0 110.314 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.83 -31.86 15.07 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.519 1.273 . . . . 0.0 110.89 179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -91.1 -39.78 11.97 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.953 -1.092 . . . . 0.0 110.222 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.0 t -60.01 -49.18 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.568 0 O-C-N 121.155 -0.966 . . . . 0.0 109.663 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.445 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 16.5 mtp180 -58.56 -51.73 68.64 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.079 -1.013 . . . . 0.0 109.609 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -40.6 97.6 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.262 -0.975 . . . . 0.0 108.818 179.014 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 93.8 m -56.0 -42.88 77.08 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.077 -1.014 . . . . 0.0 108.37 178.316 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -63.53 -36.38 83.59 Favored 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.152 178.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 t -100.16 43.85 1.04 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.138 -0.976 . . . . 0.0 110.473 -179.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.77 38.49 3.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.182 -0.949 . . . . 0.0 110.138 179.773 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.95 127.32 2.97 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -54.63 -28.33 46.07 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.087 -1.243 . . . . 0.0 110.226 178.955 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -58.92 -33.63 70.79 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.991 -1.068 . . . . 0.0 110.681 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.606 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.84 -38.44 49.01 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.876 -1.14 . . . . 0.0 110.705 -179.41 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -63.65 -53.03 57.83 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.135 -0.978 . . . . 0.0 108.942 179.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.98 -39.89 91.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.239 -0.913 . . . . 0.0 108.944 178.642 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -56.11 -38.12 70.34 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.211 -0.931 . . . . 0.0 110.083 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.863 HG13 ' CD1' ' A' ' 8' ' ' TYR . 79.3 t -57.58 -36.8 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.069 -1.019 . . . . 0.0 110.032 179.626 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.9 tttt -53.02 -40.96 64.24 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.924 -1.11 . . . . 0.0 109.892 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -58.79 -29.67 67.0 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.223 178.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -68.55 -52.4 32.28 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.976 -1.078 . . . . 0.0 110.257 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 43.4 p90 -100.09 33.58 2.58 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.004 -1.06 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.46 -64.71 1.11 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.791 -1.193 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' CG ' ' A' ' 43' ' ' GLU . 1.3 tptm -64.42 -34.64 78.65 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.304 -0.873 . . . . 0.0 110.086 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 8.5 t90 -52.52 -48.07 66.28 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.041 -1.037 . . . . 0.0 111.278 -179.453 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -105.82 -45.22 4.44 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.02 -1.05 . . . . 0.0 111.26 -179.308 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.406 ' CG ' ' HA ' ' A' ' 40' ' ' LYS . 40.1 mm-40 53.4 37.63 25.97 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.974 -1.079 . . . . 0.0 110.704 -179.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -160.75 -66.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.222 -0.924 . . . . 0.0 110.83 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -158.54 104.87 1.82 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.264 -0.897 . . . . 0.0 110.809 -179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -145.79 70.67 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.24 -0.912 . . . . 0.0 110.326 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -120.46 36.76 4.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.373 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.7 -53.71 2.67 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.195 -0.941 . . . . 0.0 109.654 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.35 -21.05 63.66 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.196 -0.94 . . . . 0.0 111.464 179.537 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 48.5 mm -72.61 -40.1 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 120.626 -1.296 . . . . 0.0 109.777 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -65.67 -40.15 92.11 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.124 -0.985 . . . . 0.0 109.971 179.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -64.18 -35.2 80.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.136 -0.977 . . . . 0.0 110.502 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.7 m . . . . . 0 N--CA 1.504 2.251 0 O-C-N 121.008 -1.057 . . . . 0.0 110.131 179.812 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.7 mtmm . . . . . 0 N--CA 1.493 1.713 0 CA-C-O 120.691 0.281 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' HD13 ' A' ' 13' ' ' LEU . 42.3 t80 -114.75 156.43 24.84 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.965 . . . . 0.0 109.921 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -136.08 135.94 39.77 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.104 -0.997 . . . . 0.0 110.561 -179.733 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 t -111.63 93.82 4.66 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.224 -0.922 . . . . 0.0 110.202 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -52.64 -35.85 55.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.115 -0.991 . . . . 0.0 110.379 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.851 ' CD1' HG13 ' A' ' 34' ' ' VAL . 79.7 m-85 -60.86 -32.85 72.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.176 -0.952 . . . . 0.0 110.098 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.3 m -96.95 -0.71 47.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.991 -1.068 . . . . 0.0 112.084 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t70 53.07 38.64 27.88 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.367 -1.458 . . . . 0.0 110.656 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -139.43 171.68 13.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.147 -0.971 . . . . 0.0 110.036 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.17 120.39 34.08 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.184 -0.947 . . . . 0.0 110.032 -179.66 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.519 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.6 mp -78.25 166.14 23.06 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.161 -0.962 . . . . 0.0 109.558 179.43 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.492 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -102.22 -30.43 11.11 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.085 -1.009 . . . . 0.0 112.013 -179.367 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.492 ' CD2' HG23 ' A' ' 14' ' ' THR . 45.5 m-70 -113.72 139.78 48.8 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.682 -1.261 . . . . 0.0 110.5 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -116.13 94.98 4.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.359 -0.838 . . . . 0.0 109.765 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.24 176.53 2.25 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.234 -0.916 . . . . 0.0 110.169 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.49 -30.33 23.71 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 O-C-N 123.386 1.203 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.5 t -88.01 -41.47 13.09 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.931 -1.105 . . . . 0.0 109.974 179.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.3 t -59.82 -50.47 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.187 -0.946 . . . . 0.0 109.787 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' NH1' ' CE1' ' A' ' 4' ' ' PHE . 19.4 mtt180 -58.06 -51.73 68.46 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.053 -1.029 . . . . 0.0 109.611 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -60.85 -40.58 93.43 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.958 178.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.0 m -55.36 -43.04 74.7 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 121.145 -0.972 . . . . 0.0 108.507 178.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -64.37 -39.71 94.4 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.425 -0.797 . . . . 0.0 108.95 178.148 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.17 56.53 2.54 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.145 -0.972 . . . . 0.0 110.274 -179.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 37.86 3.57 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.049 -1.032 . . . . 0.0 110.403 179.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.49 125.2 2.01 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -54.71 -27.96 44.5 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.174 -1.192 . . . . 0.0 110.359 179.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 tptt -60.62 -31.78 70.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.933 -1.104 . . . . 0.0 110.764 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.597 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.2 t-80 -49.83 -42.59 47.61 Favored 'General case' 0 N--CA 1.517 2.892 0 O-C-N 120.884 -1.135 . . . . 0.0 110.865 -179.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -62.7 -52.56 62.81 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.116 -0.99 . . . . 0.0 109.109 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -61.4 -40.23 93.62 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.194 -0.941 . . . . 0.0 108.894 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -56.27 -37.94 70.5 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.324 -0.86 . . . . 0.0 109.914 179.083 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.851 HG13 ' CD1' ' A' ' 8' ' ' TYR . 78.2 t -55.95 -34.52 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.602 0 O-C-N 121.05 -1.031 . . . . 0.0 110.141 179.632 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.462 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -54.82 -42.92 72.47 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.858 -1.151 . . . . 0.0 109.763 179.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.39 -27.97 64.76 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 178.904 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.03 -52.08 26.98 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.891 -1.131 . . . . 0.0 110.325 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.466 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 40.6 p90 -99.69 32.53 2.82 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.991 -1.068 . . . . 0.0 111.404 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -82.49 -38.46 23.85 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.728 -1.233 . . . . 0.0 109.805 178.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.5 tttp -109.28 31.35 5.81 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.234 -0.916 . . . . 0.0 110.548 179.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 7.8 t90 -85.84 -40.49 15.92 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.062 -1.024 . . . . 0.0 110.134 -179.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.544 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 14.8 ptp -176.59 -43.69 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.139 -0.976 . . . . 0.0 112.038 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -116.62 176.8 4.95 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.677 -1.264 . . . . 0.0 110.452 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -101.12 -42.72 6.26 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.277 -0.89 . . . . 0.0 110.594 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -105.04 83.49 1.99 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.039 -1.038 . . . . 0.0 110.198 179.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.466 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -117.13 75.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.204 -0.935 . . . . 0.0 110.107 -179.99 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.44 35.63 3.11 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 110.461 179.598 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -110.29 -54.31 2.59 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.126 -0.984 . . . . 0.0 109.401 179.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -20.96 64.21 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.203 -0.936 . . . . 0.0 111.297 179.18 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.418 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.6 mm -71.81 -46.32 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.646 -1.284 . . . . 0.0 109.446 179.615 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -60.56 -38.47 84.65 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.236 -0.915 . . . . 0.0 110.028 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.38 -35.06 64.89 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.045 -1.034 . . . . 0.0 110.659 -179.855 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 N--CA 1.504 2.239 0 O-C-N 121.041 -1.037 . . . . 0.0 110.303 179.919 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 25.4 mttt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.624 ' HD1' HD13 ' A' ' 13' ' ' LEU . 69.8 t80 -112.78 162.01 16.25 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -131.08 136.74 48.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.466 -179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.3 t -116.16 98.37 6.58 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.264 -0.898 . . . . 0.0 109.826 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -51.82 -35.92 46.05 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.015 -1.053 . . . . 0.0 110.782 -179.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.567 ' CD2' HG13 ' A' ' 34' ' ' VAL . 78.9 m-85 -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.088 -1.008 . . . . 0.0 110.291 179.4 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.0 m -97.29 -10.49 25.6 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.097 -1.002 . . . . 0.0 111.881 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 55.91 40.78 30.48 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.462 -1.399 . . . . 0.0 110.172 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -142.11 170.72 15.19 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.22 -0.925 . . . . 0.0 109.984 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.7 t80 -117.17 125.21 50.84 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.265 -0.897 . . . . 0.0 110.398 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.624 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.3 mp -80.61 170.68 16.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.203 -0.936 . . . . 0.0 109.72 179.67 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.521 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.1 t -96.91 -30.49 13.09 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.204 -0.935 . . . . 0.0 111.334 -179.793 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 47.5 m-70 -113.69 146.44 39.82 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.875 -1.141 . . . . 0.0 110.205 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -125.95 93.52 3.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.123 -0.985 . . . . 0.0 109.727 179.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -146.73 179.75 1.11 Allowed Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.511 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -71.75 -32.12 12.1 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.341 1.18 . . . . 0.0 110.935 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -39.21 17.03 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.949 -1.094 . . . . 0.0 109.95 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 61.3 t -64.61 -47.48 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.12 -0.987 . . . . 0.0 109.609 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -57.62 -52.58 64.82 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.038 -1.039 . . . . 0.0 109.714 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -60.03 -39.84 87.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.128 -0.982 . . . . 0.0 108.943 178.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.3 m -55.08 -43.78 74.26 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.051 -1.031 . . . . 0.0 108.4 178.267 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.407 ' ND1' HD21 ' A' ' 13' ' ' LEU . 71.2 t60 -62.25 -37.46 85.53 Favored 'General case' 0 N--CA 1.504 2.252 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.34 48.46 0.99 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.216 -0.927 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.05 38.27 3.23 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.087 -1.008 . . . . 0.0 110.245 179.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.89 127.66 2.86 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -54.21 -28.52 41.52 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.106 -1.232 . . . . 0.0 110.32 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -58.68 -35.5 72.7 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.058 -1.026 . . . . 0.0 110.462 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.577 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.0 t-80 -51.74 -40.7 60.7 Favored 'General case' 0 N--CA 1.515 2.788 0 O-C-N 121.03 -1.044 . . . . 0.0 110.427 -179.709 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -63.06 -52.22 63.61 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.123 -0.986 . . . . 0.0 108.819 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.65 -39.92 93.06 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.185 -0.947 . . . . 0.0 108.868 178.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -56.21 -38.58 71.22 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.961 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.666 HG12 ' HE2' ' A' ' 38' ' ' TYR . 70.6 t -58.56 -38.89 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.125 -0.984 . . . . 0.0 109.712 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.6 mtmp? -57.29 -44.83 84.37 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.059 -1.025 . . . . 0.0 109.261 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.7 -31.81 64.85 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.339 -0.851 . . . . 0.0 110.051 178.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -64.07 -53.16 54.19 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.98 -1.075 . . . . 0.0 109.769 179.729 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.666 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -99.69 28.03 4.98 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.111 -0.993 . . . . 0.0 111.602 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -56.45 -41.0 75.74 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.637 -1.29 . . . . 0.0 110.064 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -126.94 28.42 5.81 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.248 -0.908 . . . . 0.0 111.199 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.1 t90 -52.59 -36.28 55.82 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.903 -1.123 . . . . 0.0 110.805 -179.72 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.464 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -138.35 -67.71 0.46 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.143 -0.973 . . . . 0.0 110.398 179.908 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -170.93 -52.01 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.092 -1.005 . . . . 0.0 111.138 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.08 -168.83 2.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.224 -0.922 . . . . 0.0 109.771 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -95.62 144.51 26.0 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.088 -1.008 . . . . 0.0 110.25 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HB1' HD21 ' A' ' 49' ' ' LEU . . . -123.64 84.52 2.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.224 -0.923 . . . . 0.0 110.333 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -105.49 34.39 3.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 110.598 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.8 p -112.5 -55.04 2.56 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.112 -0.993 . . . . 0.0 109.314 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.478 HD21 ' HB1' ' A' ' 46' ' ' ALA . 0.6 OUTLIER -60.06 -21.62 61.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.3 -0.875 . . . . 0.0 111.403 179.225 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG11 ' A' ' 34' ' ' VAL . 46.4 mm -68.93 -48.38 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.58 -1.325 . . . . 0.0 109.395 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -58.99 -39.18 80.99 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.165 -0.96 . . . . 0.0 110.191 -179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -56.48 -36.61 69.31 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.211 -0.931 . . . . 0.0 110.72 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.504 2.233 0 O-C-N 121.096 -1.002 . . . . 0.0 110.406 179.971 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.3 t80 -110.85 161.5 15.74 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.14 -0.975 . . . . 0.0 110.188 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -137.4 133.26 34.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.914 . . . . 0.0 110.194 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.1 t -113.91 94.64 4.92 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.118 -0.989 . . . . 0.0 110.173 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -52.85 -35.9 58.12 Favored 'General case' 0 N--CA 1.513 2.689 0 O-C-N 121.025 -1.047 . . . . 0.0 110.478 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.0 m-85 -60.59 -32.91 71.99 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.159 -0.963 . . . . 0.0 110.106 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.9 m -96.63 -3.89 42.0 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.063 -1.023 . . . . 0.0 112.181 -179.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 t70 53.69 39.12 29.8 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.383 -1.448 . . . . 0.0 110.458 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -141.98 170.72 15.18 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.217 -0.927 . . . . 0.0 109.914 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -119.49 136.74 54.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.2 mp -96.26 161.88 13.76 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.267 -0.895 . . . . 0.0 109.578 179.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.46 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.9 t -98.57 -21.81 16.29 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.076 -1.015 . . . . 0.0 111.81 -179.691 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 51.6 m-70 -114.37 143.99 44.0 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.709 -1.245 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -125.67 92.54 3.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 109.715 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -147.43 177.9 1.62 Allowed Pre-proline 0 N--CA 1.496 1.868 0 O-C-N 121.279 -0.888 . . . . 0.0 110.214 -179.518 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.51 -33.26 14.04 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.395 1.208 . . . . 0.0 110.775 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.5 m -84.2 -39.2 19.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.956 -1.09 . . . . 0.0 110.035 179.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 70.1 t -64.38 -45.93 94.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.061 -1.024 . . . . 0.0 109.451 179.75 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 -59.71 -52.28 66.17 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.175 -0.953 . . . . 0.0 109.351 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -59.55 -39.67 84.74 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.137 -0.977 . . . . 0.0 108.908 178.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -55.39 -43.68 75.41 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.143 -0.973 . . . . 0.0 108.406 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.49 -40.4 96.99 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 t -92.5 56.95 2.84 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.285 -0.884 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.36 37.9 3.4 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.086 -1.009 . . . . 0.0 110.378 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.43 123.68 1.6 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -29.65 29.7 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.104 -1.233 . . . . 0.0 110.192 178.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 6.2 ptpt -57.12 -32.87 66.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.724 179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.613 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.4 t-80 -49.82 -41.76 45.54 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.978 -1.076 . . . . 0.0 110.737 -179.612 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -62.68 -54.45 39.11 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.16 -0.962 . . . . 0.0 108.986 179.167 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.43 -39.67 88.27 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.108 178.713 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -56.76 -37.6 71.27 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.227 -0.921 . . . . 0.0 110.018 179.118 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.948 HG11 HD12 ' A' ' 50' ' ' ILE . 73.5 t -56.67 -35.95 47.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.041 -1.037 . . . . 0.0 110.268 179.71 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.7 ttmm -57.35 -44.89 84.69 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.86 -1.15 . . . . 0.0 109.677 179.357 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.29 -25.13 63.86 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.479 178.966 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.41 -50.44 15.86 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.832 -1.167 . . . . 0.0 110.676 -179.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 34.5 p90 -99.49 32.96 2.61 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.976 -1.077 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -83.97 -38.43 20.99 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.715 -1.24 . . . . 0.0 109.927 178.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -112.01 32.21 5.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.117 -0.989 . . . . 0.0 110.583 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.6 t90 -90.82 -39.2 12.49 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.152 -0.968 . . . . 0.0 110.094 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -150.58 -63.26 0.2 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.224 -0.923 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -140.47 -171.67 3.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.56 39.3 2.13 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.173 -0.955 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -147.37 74.71 1.34 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.229 -0.92 . . . . 0.0 110.241 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -142.74 72.49 1.37 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.248 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 36.36 3.89 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.284 -0.885 . . . . 0.0 110.322 179.643 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -111.04 -54.9 2.56 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -20.17 65.29 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.24 -0.912 . . . . 0.0 111.285 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.948 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -72.79 -52.95 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 O-C-N 120.719 -1.238 . . . . 0.0 109.705 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.63 -40.25 86.99 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.197 -0.939 . . . . 0.0 110.075 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 tptp -56.21 -32.23 64.21 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.075 -1.015 . . . . 0.0 110.802 -179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 m . . . . . 0 N--CA 1.507 2.395 0 O-C-N 120.961 -1.087 . . . . 0.0 110.816 -179.883 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.7 mttt . . . . . 0 N--CA 1.495 1.796 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -115.48 162.12 17.63 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.186 -0.946 . . . . 0.0 110.101 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -140.12 132.51 28.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.157 -0.965 . . . . 0.0 110.284 -179.621 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.4 t -113.66 90.09 3.25 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.21 -0.932 . . . . 0.0 109.967 179.403 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -51.65 -35.75 43.37 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.029 -1.044 . . . . 0.0 110.348 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 87.1 m-85 -59.56 -31.65 69.63 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.978 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.8 m -98.24 0.02 44.92 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.016 -1.053 . . . . 0.0 112.258 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t0 52.63 38.9 27.2 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.381 -1.45 . . . . 0.0 110.666 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -143.21 172.15 13.12 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.32 -0.862 . . . . 0.0 110.029 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -123.6 139.73 53.71 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.287 -0.883 . . . . 0.0 110.871 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -100.44 163.09 12.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.264 -0.897 . . . . 0.0 109.36 179.314 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.503 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.72 -30.91 11.46 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.064 -1.022 . . . . 0.0 111.849 -179.247 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' A' ' 14' ' ' THR . 47.9 m-70 -113.02 134.89 54.31 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.792 -1.193 . . . . 0.0 110.3 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -115.39 82.43 1.75 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.178 -0.951 . . . . 0.0 109.776 179.731 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -126.32 -179.93 1.03 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.288 -0.882 . . . . 0.0 110.008 -179.658 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.24 -29.37 17.32 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.364 1.192 . . . . 0.0 111.099 179.979 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 t -88.84 -46.31 9.04 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.867 -1.145 . . . . 0.0 110.033 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.46 HG11 ' HB2' ' A' ' 15' ' ' HIS . 91.2 t -58.55 -55.09 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.133 -0.98 . . . . 0.0 109.98 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -55.55 -50.83 68.99 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.067 -1.021 . . . . 0.0 109.85 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.5 mttm -61.88 -39.85 93.34 Favored 'General case' 0 N--CA 1.506 2.36 0 C-N-CA 119.298 -0.961 . . . . 0.0 108.867 178.781 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 74.0 m -54.88 -42.95 72.71 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.11 -0.994 . . . . 0.0 108.433 178.267 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -62.25 -39.51 93.1 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.887 178.119 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -94.7 53.22 1.6 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.287 -0.883 . . . . 0.0 110.417 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.34 39.83 3.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.088 -1.008 . . . . 0.0 109.992 179.648 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.13 154.07 21.44 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -83.83 -10.26 58.17 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.327 -1.102 . . . . 0.0 111.074 178.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttm -90.51 -24.36 20.67 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.696 -1.253 . . . . 0.0 111.115 179.471 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.0 t-80 -48.63 -38.75 21.86 Favored 'General case' 0 N--CA 1.517 2.911 0 O-C-N 120.767 -1.208 . . . . 0.0 110.853 -179.716 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -65.53 -53.78 37.36 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.275 -0.97 . . . . 0.0 108.83 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.29 -39.33 90.05 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.17 -0.956 . . . . 0.0 108.981 178.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -56.66 -37.16 70.43 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.21 -0.931 . . . . 0.0 110.167 179.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 58.0 t -58.62 -43.4 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.024 -1.047 . . . . 0.0 109.726 179.837 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 24.1 ttmt -62.32 -43.25 99.25 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.986 179.086 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -60.61 -24.43 65.49 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.295 178.625 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -75.81 -51.83 11.73 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.764 -1.21 . . . . 0.0 110.452 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.516 ' HE2' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -98.94 28.99 4.02 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.002 -1.061 . . . . 0.0 111.643 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.08 -41.41 97.32 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.66 -1.275 . . . . 0.0 109.664 179.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -117.49 25.91 10.09 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.362 -0.836 . . . . 0.0 111.162 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.484 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.2 t90 -56.87 -39.25 73.98 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.963 -1.085 . . . . 0.0 110.344 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.484 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.2 ttm -147.03 33.55 0.91 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 49.79 37.59 13.64 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.955 -1.091 . . . . 0.0 111.258 179.692 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -145.01 -171.64 3.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.157 -0.964 . . . . 0.0 110.408 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -111.02 128.42 55.85 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.186 -0.946 . . . . 0.0 110.057 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.4 75.82 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.286 -0.884 . . . . 0.0 110.314 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.99 35.64 3.17 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.195 -0.94 . . . . 0.0 110.319 179.411 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.9 t -111.26 -55.58 2.48 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.151 -0.968 . . . . 0.0 109.294 179.277 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -20.84 65.53 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.229 -0.92 . . . . 0.0 111.118 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.796 HD12 HG11 ' A' ' 34' ' ' VAL . 47.0 mm -71.91 -49.09 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.668 -1.27 . . . . 0.0 109.546 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.4 -41.37 80.57 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.123 -0.986 . . . . 0.0 109.939 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.4 mmtm -59.95 -34.98 73.98 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.159 -0.963 . . . . 0.0 110.478 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.8 m . . . . . 0 N--CA 1.503 2.206 0 O-C-N 120.996 -1.065 . . . . 0.0 110.518 -179.937 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.637 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.0 t80 -112.16 162.55 15.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.161 -0.962 . . . . 0.0 110.466 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -132.22 139.65 48.39 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.15 -0.969 . . . . 0.0 110.223 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -121.06 96.86 5.26 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.08 -1.013 . . . . 0.0 110.098 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -53.53 -36.4 61.74 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.061 -1.024 . . . . 0.0 110.407 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.807 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.8 m-85 -60.7 -32.02 71.27 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.095 -1.003 . . . . 0.0 110.125 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.9 m -96.82 -6.07 36.88 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.966 -1.084 . . . . 0.0 112.126 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 54.17 39.45 30.73 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.453 -1.405 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.4 t -144.71 169.92 17.08 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.267 -0.895 . . . . 0.0 110.021 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -115.84 130.94 57.04 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.205 -0.934 . . . . 0.0 110.425 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.637 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.5 mp -84.88 169.3 14.25 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.183 -0.948 . . . . 0.0 109.756 179.615 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.633 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.7 t -100.81 -21.83 15.03 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.195 -0.941 . . . . 0.0 112.108 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.633 ' CD2' HG23 ' A' ' 14' ' ' THR . 47.3 m-70 -126.26 143.44 51.15 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.616 -1.303 . . . . 0.0 110.315 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -120.79 92.04 3.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -139.06 178.21 1.74 Allowed Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.227 -0.921 . . . . 0.0 109.985 -179.55 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.66 -29.43 19.58 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.394 1.207 . . . . 0.0 111.114 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -90.96 -41.61 11.03 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.899 -1.126 . . . . 0.0 110.033 179.612 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.564 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.7 t -60.11 -49.82 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.807 179.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -57.96 -51.67 68.68 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.066 -1.021 . . . . 0.0 109.661 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -61.81 -40.37 95.03 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.16 -0.962 . . . . 0.0 108.799 178.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -55.16 -43.1 73.95 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.142 -0.974 . . . . 0.0 108.382 178.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -63.07 -38.97 93.31 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.66 50.97 1.14 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.22 -0.925 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.7 m -117.79 37.73 3.85 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.096 -1.002 . . . . 0.0 110.313 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.77 126.95 2.77 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.2 ttt85 -54.4 -28.44 43.61 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.235 -1.156 . . . . 0.0 110.319 179.078 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -59.2 -34.76 72.54 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.96 -1.088 . . . . 0.0 110.35 179.861 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.704 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.1 t-80 -51.14 -40.19 58.0 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.912 -1.117 . . . . 0.0 110.514 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -63.33 -54.68 33.24 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.263 -0.975 . . . . 0.0 109.025 179.182 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.69 -39.52 88.81 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 178.68 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -57.01 -37.76 72.14 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.199 -0.938 . . . . 0.0 110.035 179.18 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.807 HG13 ' CD1' ' A' ' 8' ' ' TYR . 85.8 t -56.5 -34.04 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 O-C-N 121.093 -1.004 . . . . 0.0 110.253 179.75 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.8 tttp -52.85 -40.95 63.82 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.855 -1.153 . . . . 0.0 110.029 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -59.33 -29.6 67.76 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.261 178.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -68.05 -51.55 45.4 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.94 -1.1 . . . . 0.0 110.327 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.681 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 45.0 p90 -100.16 35.62 2.04 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.068 -1.02 . . . . 0.0 111.157 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -87.95 -37.91 16.01 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.863 -1.148 . . . . 0.0 110.001 178.694 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -110.79 29.63 7.57 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.273 -0.892 . . . . 0.0 110.865 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.428 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 26.5 t90 -93.98 -42.74 8.89 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.02 -1.05 . . . . 0.0 110.01 179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.428 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -145.59 -60.28 0.34 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.206 -0.934 . . . . 0.0 110.382 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -146.08 -171.17 3.66 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.128 -0.983 . . . . 0.0 110.266 -179.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -106.59 39.57 1.81 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.122 -0.986 . . . . 0.0 110.137 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -150.75 76.14 1.24 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.259 -0.9 . . . . 0.0 110.405 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.681 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -141.15 73.66 1.43 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.17 -0.956 . . . . 0.0 110.297 -179.902 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.22 35.49 4.63 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.597 179.673 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 5.5 p -110.58 -54.18 2.61 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.068 -1.02 . . . . 0.0 109.463 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -61.47 -20.9 63.66 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.183 -0.948 . . . . 0.0 111.377 179.28 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.55 HD12 HG11 ' A' ' 34' ' ' VAL . 47.3 mm -71.56 -42.64 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 120.719 -1.238 . . . . 0.0 109.509 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -65.22 -39.57 92.95 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.161 -0.962 . . . . 0.0 110.053 -179.998 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -64.36 -34.83 79.07 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.08 -1.013 . . . . 0.0 110.626 -179.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m . . . . . 0 N--CA 1.505 2.28 0 O-C-N 120.993 -1.067 . . . . 0.0 110.447 179.975 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt . . . . . 0 N--CA 1.505 2.309 0 CA-C-O 121.04 0.447 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.402 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 39.3 t80 -112.26 151.9 29.1 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.041 -1.037 . . . . 0.0 110.19 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -125.93 137.18 53.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.19 -0.944 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 36.2 t -114.77 92.37 3.92 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.213 -0.929 . . . . 0.0 110.061 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -51.45 -35.94 41.87 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.093 -1.004 . . . . 0.0 110.361 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.675 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -60.0 -31.08 69.59 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.138 -0.976 . . . . 0.0 110.008 178.882 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' HG22 ' A' ' 11' ' ' THR . 32.1 m -98.9 0.84 44.96 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.002 -1.061 . . . . 0.0 112.237 179.916 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.1 38.34 23.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.315 -1.491 . . . . 0.0 110.679 -179.662 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.423 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.0 t -146.61 171.68 14.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.987 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.401 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER -125.94 126.5 44.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.251 -179.73 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -77.32 167.43 21.72 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.173 -0.955 . . . . 0.0 109.885 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.1 t -100.15 -30.49 11.9 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.137 -0.977 . . . . 0.0 111.635 -179.702 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.472 ' HB2' HG11 ' A' ' 20' ' ' VAL . 35.6 m-70 -110.4 144.63 38.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.772 -1.205 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -121.87 95.31 4.61 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.77 177.93 1.67 Allowed Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.192 -0.943 . . . . 0.0 110.158 -179.578 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.2 Cg_endo -71.16 -32.41 13.09 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.396 1.209 . . . . 0.0 110.916 179.859 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 t -87.4 -40.02 14.75 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.974 -1.079 . . . . 0.0 110.0 179.588 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.472 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.1 t -61.11 -45.62 98.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.131 -0.981 . . . . 0.0 109.612 179.724 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 46.8 mtt180 -60.0 -53.79 53.71 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.096 -1.002 . . . . 0.0 109.483 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -59.79 -39.51 85.2 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.142 -0.974 . . . . 0.0 109.026 178.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.7 m -55.31 -42.79 74.19 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.075 -1.016 . . . . 0.0 108.517 178.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -63.12 -37.05 85.67 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.153 178.116 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 49.01 1.02 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.116 -0.99 . . . . 0.0 110.509 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 m -115.51 38.6 3.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.104 -0.997 . . . . 0.0 110.182 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.2 126.03 2.4 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.8 ttm-85 -53.31 -29.18 32.28 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.115 -1.226 . . . . 0.0 110.398 179.046 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 -33.92 70.14 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.042 -1.036 . . . . 0.0 110.654 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -51.34 -38.92 55.67 Favored 'General case' 0 N--CA 1.516 2.84 0 O-C-N 120.908 -1.12 . . . . 0.0 110.603 -179.591 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -62.99 -53.85 47.53 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.089 179.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.49 -39.26 87.05 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.22 -0.925 . . . . 0.0 108.956 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.52 -39.07 70.06 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.212 -0.93 . . . . 0.0 110.083 179.208 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.675 HG13 ' CD2' ' A' ' 8' ' ' TYR . 76.4 t -60.17 -36.44 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.071 -1.018 . . . . 0.0 109.761 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 61.2 tttp -52.75 -40.35 63.01 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.974 -1.078 . . . . 0.0 109.993 179.565 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.87 -33.44 68.7 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 179.12 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -63.94 -52.63 58.88 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.082 -1.011 . . . . 0.0 109.961 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.588 ' HE2' HG12 ' A' ' 34' ' ' VAL . 48.8 p90 -100.34 33.72 2.59 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.142 -0.973 . . . . 0.0 111.109 179.631 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -81.39 -38.81 25.96 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.781 -1.199 . . . . 0.0 110.181 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -117.08 21.21 13.37 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.244 -0.91 . . . . 0.0 111.636 179.791 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.6 t90 -59.85 -40.0 87.09 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.827 -1.171 . . . . 0.0 110.038 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.507 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 4.6 mtm -149.9 37.99 0.73 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -0.968 . . . . 0.0 110.59 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.16 38.18 20.32 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.0 -1.063 . . . . 0.0 110.975 179.924 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -145.99 -172.98 4.04 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.252 -0.905 . . . . 0.0 110.418 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -113.58 125.12 53.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 110.121 179.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -124.29 76.17 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.208 -0.932 . . . . 0.0 110.311 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.44 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -106.74 36.15 2.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.178 -0.951 . . . . 0.0 110.379 179.479 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -113.12 -54.9 2.58 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.214 -0.928 . . . . 0.0 109.571 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -22.01 61.55 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.186 -0.946 . . . . 0.0 111.463 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.561 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -68.34 -47.13 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 120.606 -1.309 . . . . 0.0 109.371 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -57.54 -36.7 71.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.155 -0.966 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -77.18 -34.81 56.24 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.016 -1.053 . . . . 0.0 110.643 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.4 m . . . . . 0 N--CA 1.506 2.368 0 O-C-N 121.034 -1.041 . . . . 0.0 110.26 179.977 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 30.3 mttp . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.614 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.4 t80 -109.62 161.86 14.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.219 -0.926 . . . . 0.0 110.118 179.991 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -136.51 135.33 38.44 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.141 -0.974 . . . . 0.0 110.24 -179.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -116.84 92.72 3.94 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.146 -0.971 . . . . 0.0 110.001 179.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -51.78 -35.77 45.05 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.014 -1.054 . . . . 0.0 110.408 179.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.5 m-85 -60.04 -32.95 71.39 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.133 -0.979 . . . . 0.0 110.004 179.008 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 m -95.54 -2.83 47.71 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.051 -1.031 . . . . 0.0 112.254 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.23 39.71 30.12 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.324 -1.485 . . . . 0.0 110.399 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -145.66 171.4 14.77 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.359 -0.838 . . . . 0.0 110.191 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 14.0 t80 -118.41 140.37 49.96 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.246 -0.909 . . . . 0.0 110.565 -179.517 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.614 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.3 mp -96.72 167.19 11.27 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.204 -0.935 . . . . 0.0 109.623 179.517 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.517 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -100.05 -29.81 12.32 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.847 -179.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.694 ' HB2' HG11 ' A' ' 20' ' ' VAL . 51.3 m-70 -113.0 147.58 36.87 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.742 -1.223 . . . . 0.0 110.379 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -126.55 93.93 3.92 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.238 -0.914 . . . . 0.0 109.789 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -146.61 177.83 1.64 Allowed Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.194 -0.941 . . . . 0.0 110.277 -179.598 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -69.95 -27.66 25.31 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.383 1.202 . . . . 0.0 111.154 179.824 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.75 -39.0 12.04 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.92 -1.113 . . . . 0.0 110.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.694 HG11 ' HB2' ' A' ' 15' ' ' HIS . 80.8 t -62.93 -49.26 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.001 -1.062 . . . . 0.0 109.562 179.809 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -57.55 -48.43 79.33 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.141 -0.975 . . . . 0.0 109.635 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.0 -41.26 97.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.196 -0.94 . . . . 0.0 108.725 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.4 m -54.21 -43.22 70.61 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.18 -0.95 . . . . 0.0 108.439 178.336 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -63.19 -39.39 94.52 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 119.636 -0.826 . . . . 0.0 108.871 177.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -95.3 53.61 1.53 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.223 -0.923 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.55 37.83 3.79 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.094 -1.004 . . . . 0.0 110.33 179.859 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.79 126.62 2.31 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -28.54 46.48 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.129 -1.218 . . . . 0.0 110.102 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -57.14 -33.05 67.0 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.002 -1.061 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -49.36 -37.87 26.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.99 -1.069 . . . . 0.0 110.915 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -59.65 -56.38 22.58 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.096 -1.002 . . . . 0.0 109.479 179.465 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.25 -38.89 81.15 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.227 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.54 -36.69 69.53 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.106 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.865 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.3 t -55.65 -35.46 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.056 -1.028 . . . . 0.0 110.31 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.5 mtpt -52.93 -40.38 63.56 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.879 -1.138 . . . . 0.0 110.115 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.97 -29.95 63.67 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 179.11 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.61 -53.31 23.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.907 -1.121 . . . . 0.0 110.094 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 41.1 p90 -100.2 36.01 1.96 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.117 -0.99 . . . . 0.0 111.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.71 -36.76 23.46 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.705 -1.247 . . . . 0.0 110.359 179.144 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mttp -104.8 23.63 13.15 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.217 -0.927 . . . . 0.0 111.229 179.564 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.474 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.3 t90 -105.19 -49.87 3.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.886 -1.134 . . . . 0.0 110.414 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.474 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -104.94 -47.97 3.87 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.142 -0.974 . . . . 0.0 110.38 179.939 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 54.62 38.62 30.25 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.917 -1.114 . . . . 0.0 110.628 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -151.77 -65.94 0.18 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.21 -0.931 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.35 82.41 0.41 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.165 -0.959 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.64 73.04 1.5 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.372 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -121.12 33.67 5.47 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.157 -0.964 . . . . 0.0 110.609 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -50.44 3.04 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.027 -1.046 . . . . 0.0 109.825 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -21.08 63.5 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.179 -0.95 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.842 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.36 -38.73 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 O-C-N 120.673 -1.267 . . . . 0.0 109.944 179.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -83.55 -39.21 20.69 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.121 -0.987 . . . . 0.0 110.079 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -37.89 89.06 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.132 -0.98 . . . . 0.0 110.007 179.596 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.0 m . . . . . 0 N--CA 1.507 2.414 0 O-C-N 121.079 -1.013 . . . . 0.0 110.287 179.756 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.444 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 53.8 mttp . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.68 ' HD2' HD13 ' A' ' 13' ' ' LEU . 67.5 t80 -110.14 161.73 15.28 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.226 -0.921 . . . . 0.0 110.06 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -125.44 133.91 52.29 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.25 99.75 7.84 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.068 -1.02 . . . . 0.0 110.003 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -52.74 -36.02 56.99 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 120.977 -1.077 . . . . 0.0 110.548 179.942 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 94.9 m-85 -62.8 -30.43 71.46 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.097 -1.002 . . . . 0.0 110.267 179.243 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 50.0 m -99.84 -12.04 20.23 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.981 -1.074 . . . . 0.0 111.979 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.5 t70 57.14 41.88 26.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.405 -1.434 . . . . 0.0 109.972 -179.42 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -143.73 174.23 10.98 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 5.7 t80 -115.8 112.72 22.4 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.274 -0.892 . . . . 0.0 110.46 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.697 HD21 ' ND1' ' A' ' 24' ' ' HIS . 3.6 mp -65.91 171.27 4.57 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.233 -0.917 . . . . 0.0 109.713 179.688 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.533 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.5 t -97.34 -30.1 13.14 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.235 -0.916 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.8 m-70 -115.45 148.87 38.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.952 -1.092 . . . . 0.0 110.34 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -126.45 93.97 3.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 109.692 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -147.24 178.87 1.3 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.201 -0.937 . . . . 0.0 110.082 -179.641 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.58 -31.18 13.89 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.326 1.172 . . . . 0.0 110.971 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 t -88.13 -38.78 15.08 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.958 -1.089 . . . . 0.0 110.029 179.443 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 64.3 t -61.89 -45.84 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 121.081 -1.012 . . . . 0.0 109.416 179.568 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 24.5 mtt180 -59.35 -52.24 66.48 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.464 179.768 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -41.02 97.9 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.858 178.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -56.19 -43.22 78.25 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.098 -1.001 . . . . 0.0 108.564 178.249 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.697 ' ND1' HD21 ' A' ' 13' ' ' LEU . 64.8 t60 -61.71 -34.56 76.01 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.27 178.086 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -100.47 40.35 1.27 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.071 -1.018 . . . . 0.0 110.633 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 28.8 m -116.27 38.5 3.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.171 -0.956 . . . . 0.0 110.003 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.65 129.93 4.53 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -54.57 -28.56 46.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.189 -1.183 . . . . 0.0 110.403 179.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -60.07 -36.85 78.27 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.964 -1.085 . . . . 0.0 110.475 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -51.38 -36.37 43.02 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 120.942 -1.099 . . . . 0.0 110.632 -179.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -55.57 -52.03 65.1 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.0 -1.063 . . . . 0.0 109.768 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -61.11 -40.53 94.09 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.405 -0.918 . . . . 0.0 108.996 178.778 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -56.56 -37.07 70.03 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.252 -0.905 . . . . 0.0 110.3 179.171 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 50' ' ' ILE . 97.6 t -64.94 -37.02 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.083 -1.011 . . . . 0.0 110.048 179.8 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.1 tppt? -53.71 -42.43 68.04 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 120.83 -1.169 . . . . 0.0 109.925 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.66 -28.04 65.34 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.424 179.067 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -72.86 -51.54 18.33 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.893 -1.129 . . . . 0.0 110.528 -179.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.2 p90 -99.63 35.4 2.0 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.03 -1.044 . . . . 0.0 111.415 179.97 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.68 -39.11 15.27 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.828 -1.17 . . . . 0.0 109.98 178.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -116.72 34.22 5.18 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.252 -0.905 . . . . 0.0 110.599 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.4 t90 -91.51 -39.03 12.16 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.175 -0.953 . . . . 0.0 110.282 -179.853 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 mtm -154.32 -67.24 0.14 Allowed 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.121 -0.987 . . . . 0.0 110.579 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -135.05 -171.82 2.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.192 -0.943 . . . . 0.0 110.126 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -110.12 39.42 2.16 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.0 110.154 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -146.7 74.33 1.35 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.162 -0.961 . . . . 0.0 110.266 179.876 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.41 73.35 1.37 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.95 35.06 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.113 -0.992 . . . . 0.0 110.502 179.58 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 59.9 p -109.71 -53.48 2.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.149 -0.969 . . . . 0.0 109.473 179.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -20.96 63.48 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.216 -0.928 . . . . 0.0 111.339 179.205 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 34' ' ' VAL . 49.0 mm -74.33 -47.21 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.66 -1.275 . . . . 0.0 109.701 179.628 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -58.27 -40.03 80.81 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.214 -0.928 . . . . 0.0 110.068 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.1 mttm -57.41 -35.91 70.65 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.577 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.4 m . . . . . 0 N--CA 1.504 2.232 0 O-C-N 120.965 -1.084 . . . . 0.0 110.394 179.921 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.497 1.886 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -115.23 159.47 20.93 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.191 -0.943 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -136.61 139.48 42.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.099 -1.001 . . . . 0.0 110.7 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.1 t -112.23 96.98 6.33 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.896 . . . . 0.0 110.105 179.519 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -54.8 -36.43 64.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.056 -1.028 . . . . 0.0 110.339 179.865 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.864 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.0 m-85 -60.44 -32.08 71.02 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.117 -0.989 . . . . 0.0 110.049 179.23 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.7 m -96.91 -2.74 43.16 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.957 -1.089 . . . . 0.0 112.14 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 53.77 38.69 29.08 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.397 -1.44 . . . . 0.0 110.475 -179.545 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -140.1 174.85 10.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -0.912 . . . . 0.0 109.899 179.894 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.79 121.77 38.9 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.268 -0.895 . . . . 0.0 110.258 -179.633 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -80.52 166.51 21.11 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.043 -1.036 . . . . 0.0 109.544 179.371 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.516 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -100.89 -29.5 12.19 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.125 -0.984 . . . . 0.0 111.891 -179.535 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.68 ' HB2' HG11 ' A' ' 20' ' ' VAL . 53.0 m-70 -112.23 146.79 37.52 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.824 -1.173 . . . . 0.0 110.276 -179.821 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -125.13 93.51 3.9 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 109.849 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.21 178.68 1.36 Allowed Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.39 -31.27 14.26 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.267 1.14 . . . . 0.0 110.87 179.888 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -87.16 -40.15 14.86 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.937 -1.102 . . . . 0.0 109.979 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 15' ' ' HIS . 85.3 t -61.57 -49.03 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 121.183 -0.948 . . . . 0.0 109.476 179.655 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.6 mtp-105 -58.39 -50.76 72.51 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.53 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -62.08 -41.16 97.9 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.111 -0.993 . . . . 0.0 108.803 178.803 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.4 m -55.67 -43.38 76.3 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.13 -0.981 . . . . 0.0 108.451 178.376 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -62.33 -38.76 90.72 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.404 -0.81 . . . . 0.0 108.922 178.02 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -92.7 55.86 2.53 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.227 -0.921 . . . . 0.0 110.31 -179.988 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.98 37.4 4.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.055 -1.028 . . . . 0.0 110.326 179.789 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.28 128.64 3.46 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.0 ttp-105 -54.64 -28.12 44.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.171 -1.193 . . . . 0.0 110.639 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -62.47 -34.1 76.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.929 -1.107 . . . . 0.0 110.574 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.7 t-80 -51.58 -41.78 61.43 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.946 -1.096 . . . . 0.0 110.583 -179.595 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -62.54 -54.65 36.7 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.091 179.31 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -39.15 83.9 Favored 'General case' 0 N--CA 1.508 2.471 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.117 178.572 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -55.94 -38.18 69.97 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.227 -0.92 . . . . 0.0 110.069 179.172 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.864 HG13 ' CD1' ' A' ' 8' ' ' TYR . 95.2 t -65.95 -34.51 70.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.148 -0.97 . . . . 0.0 110.025 179.61 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 25.4 tttt -52.14 -39.92 60.64 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.909 -1.119 . . . . 0.0 109.983 179.431 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -59.07 -29.49 67.37 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 178.903 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -71.72 -53.09 14.6 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.862 -1.149 . . . . 0.0 110.278 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.687 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 37.0 p90 -99.27 32.0 2.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.068 -1.02 . . . . 0.0 111.448 179.852 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.47 -38.94 54.59 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.728 -1.232 . . . . 0.0 110.138 179.166 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.11 31.28 5.83 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.212 -0.93 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.8 t90 -108.51 -57.42 2.13 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.073 -1.017 . . . . 0.0 110.404 -179.758 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.461 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.5 OUTLIER -123.11 54.05 1.27 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.232 -0.918 . . . . 0.0 110.015 -179.989 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 -171.36 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.022 -1.049 . . . . 0.0 110.581 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -82.29 -172.86 4.23 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.163 -0.961 . . . . 0.0 110.0 179.987 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 54.76 73.89 0.38 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.015 -1.053 . . . . 0.0 110.493 -179.801 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.687 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -148.97 69.99 1.09 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.202 -0.936 . . . . 0.0 110.413 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -114.0 33.94 4.94 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.274 -0.891 . . . . 0.0 110.589 179.62 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -105.9 -51.6 2.96 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.053 -1.03 . . . . 0.0 109.309 179.198 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.4 -21.65 62.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.239 -0.913 . . . . 0.0 111.355 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.736 HD12 HG11 ' A' ' 34' ' ' VAL . 50.1 mm -79.27 -46.31 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.595 -1.316 . . . . 0.0 109.741 179.633 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.72 -37.62 82.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.1 tptt -75.74 -35.53 60.18 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.148 -0.97 . . . . 0.0 110.584 179.946 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.506 2.335 0 O-C-N 121.08 -1.012 . . . . 0.0 110.071 179.852 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.448 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 26.3 mttt . . . . . 0 N--CA 1.501 2.123 0 CA-C-O 120.858 0.361 . . . . 0.0 110.67 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.626 ' HD1' HD13 ' A' ' 13' ' ' LEU . 55.6 t80 -54.65 156.73 3.35 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.089 -1.007 . . . . 0.0 110.937 -179.553 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -137.75 129.75 28.82 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.36 -0.838 . . . . 0.0 109.145 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.2 t -109.99 92.69 4.15 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.024 -1.047 . . . . 0.0 110.523 179.89 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.13 -35.35 59.59 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.059 -1.026 . . . . 0.0 110.201 179.327 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.828 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -60.44 -34.43 73.97 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.109 -0.995 . . . . 0.0 109.941 179.14 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.8 m -96.27 -0.29 49.9 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.089 -1.007 . . . . 0.0 112.136 -179.922 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.55 38.57 26.07 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.365 -1.459 . . . . 0.0 110.678 -179.755 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -139.56 166.97 23.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.979 . . . . 0.0 110.042 179.9 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.448 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 22.4 t80 -120.35 127.11 52.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.211 -0.931 . . . . 0.0 110.22 -179.712 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.626 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -84.86 167.58 15.87 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.527 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.529 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -99.47 -31.62 11.55 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.114 -0.991 . . . . 0.0 111.708 -179.34 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.529 ' CD2' HG23 ' A' ' 14' ' ' THR . 36.9 m-70 -117.72 139.43 51.05 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.899 -1.126 . . . . 0.0 110.278 -179.872 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -114.66 94.18 4.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.215 -0.928 . . . . 0.0 109.821 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -139.21 178.72 1.52 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.292 -0.88 . . . . 0.0 110.072 -179.653 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.76 -32.2 14.81 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.351 1.185 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.72 -44.4 11.83 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.966 -1.084 . . . . 0.0 109.737 179.44 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.2 t -60.43 -51.35 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 121.17 -0.956 . . . . 0.0 109.552 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -58.49 -50.47 73.62 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.084 -1.01 . . . . 0.0 109.393 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -61.32 -40.12 93.05 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.874 178.77 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 68.9 m -54.07 -42.87 69.78 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.105 -0.997 . . . . 0.0 108.562 178.262 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -63.06 -39.85 95.93 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.361 -0.837 . . . . 0.0 108.898 178.135 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.81 56.64 2.35 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.32 -0.862 . . . . 0.0 110.089 -179.912 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.95 37.74 3.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.154 -0.966 . . . . 0.0 110.362 179.892 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -149.51 124.59 1.82 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.991 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -28.31 39.13 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.075 -1.25 . . . . 0.0 110.4 178.946 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -60.07 -31.34 69.92 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.948 -1.095 . . . . 0.0 110.691 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.508 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.1 t-80 -49.04 -38.1 22.87 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.91 -1.119 . . . . 0.0 110.986 -179.499 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.21 -54.66 29.96 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.014 179.284 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -60.91 -39.28 88.75 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.034 178.703 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -55.94 -37.04 68.44 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.191 -0.943 . . . . 0.0 110.075 179.15 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.828 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.1 t -55.22 -36.44 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.635 0 O-C-N 121.033 -1.042 . . . . 0.0 110.035 179.769 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.4 tttt -57.6 -42.24 82.84 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 120.969 -1.082 . . . . 0.0 109.481 179.309 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -59.18 -26.86 65.17 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.305 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -70.12 -52.52 23.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.893 -1.129 . . . . 0.0 110.406 -179.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.538 ' HE1' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -97.45 20.94 10.85 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.036 -1.04 . . . . 0.0 111.947 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -61.48 -40.0 92.97 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.6 -1.312 . . . . 0.0 109.848 179.192 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.22 31.38 6.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.23 -0.919 . . . . 0.0 110.875 179.723 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CE2' ' HE1' ' A' ' 42' ' ' MET . 24.2 t90 -77.29 -59.17 2.89 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.133 -0.979 . . . . 0.0 110.316 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.427 ' HE1' ' CE2' ' A' ' 41' ' ' TRP . 7.1 tpp -137.52 -59.55 0.67 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.121 -0.987 . . . . 0.0 110.539 -179.788 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -114.86 -173.54 2.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.162 -0.961 . . . . 0.0 110.411 -179.797 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -97.49 -35.78 10.54 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.27 -0.894 . . . . 0.0 110.849 -179.946 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -106.13 83.79 1.95 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.93 -1.106 . . . . 0.0 110.399 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.505 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -115.47 70.41 0.75 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.247 -0.908 . . . . 0.0 109.873 179.715 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.66 34.86 4.53 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.199 -0.938 . . . . 0.0 110.54 179.847 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 t -107.49 -53.78 2.57 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.087 -1.008 . . . . 0.0 109.213 179.118 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.17 -20.7 64.41 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.307 -0.87 . . . . 0.0 111.31 179.109 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.526 HD12 HG11 ' A' ' 34' ' ' VAL . 49.4 mm -77.58 -40.64 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 120.731 -1.231 . . . . 0.0 109.894 179.797 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -58.53 -38.65 78.22 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.175 -0.953 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -73.46 -37.35 65.83 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.157 -0.964 . . . . 0.0 110.202 179.772 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.506 2.363 0 O-C-N 121.045 -1.035 . . . . 0.0 110.366 179.742 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.41 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 5.8 mtmm . . . . . 0 N--CA 1.496 1.833 0 N-CA-C 110.248 -0.279 . . . . 0.0 110.248 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 13' ' ' LEU . 64.6 t80 -111.28 157.86 19.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.158 -0.964 . . . . 0.0 110.141 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -125.95 135.72 52.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.164 -0.96 . . . . 0.0 110.62 -179.755 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.3 t -113.34 95.0 5.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.188 -0.945 . . . . 0.0 110.019 179.495 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -53.03 -36.08 60.15 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.062 -1.024 . . . . 0.0 110.478 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.836 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.0 m-85 -60.19 -32.96 71.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.088 -1.007 . . . . 0.0 109.927 179.108 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' HG22 ' A' ' 11' ' ' THR . 25.1 m -95.47 -0.08 52.7 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.011 -1.056 . . . . 0.0 112.061 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.95 38.57 24.06 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.435 -1.416 . . . . 0.0 110.635 -179.783 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.6 t -148.9 171.15 16.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.291 -0.881 . . . . 0.0 110.149 179.933 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -117.36 124.94 50.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.198 -0.939 . . . . 0.0 110.238 -179.664 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.479 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.3 mp -74.2 170.16 16.11 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.132 -0.98 . . . . 0.0 109.784 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.541 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.6 t -101.02 -21.36 15.05 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.236 -0.915 . . . . 0.0 112.176 -179.712 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.716 ' HB2' HG11 ' A' ' 20' ' ' VAL . 48.9 m-70 -119.4 147.28 44.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.53 -1.356 . . . . 0.0 110.291 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -124.47 94.84 4.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.22 -0.925 . . . . 0.0 109.961 179.813 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.67 177.4 1.79 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.187 -0.946 . . . . 0.0 110.413 -179.625 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.86 -32.71 13.58 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.41 1.216 . . . . 0.0 110.845 179.849 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 m -87.26 -38.95 15.84 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.043 -1.036 . . . . 0.0 110.027 179.552 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.716 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.0 t -60.38 -49.31 84.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 179.645 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.405 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 19.9 mtt180 -58.26 -50.81 72.29 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.079 -1.013 . . . . 0.0 109.605 179.648 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.57 -41.33 98.87 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.346 -0.941 . . . . 0.0 108.748 178.825 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.5 m -55.96 -43.29 77.36 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.221 -0.924 . . . . 0.0 108.625 178.416 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.479 ' ND1' HD21 ' A' ' 13' ' ' LEU . 76.4 t60 -61.79 -36.25 80.55 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.701 -0.8 . . . . 0.0 109.199 178.218 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.14 52.31 1.28 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.135 -0.978 . . . . 0.0 110.274 -179.813 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -116.49 37.98 3.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.244 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.12 127.1 2.77 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 -179.981 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.7 ttt-85 -54.93 -28.05 47.98 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.097 -1.237 . . . . 0.0 110.342 179.179 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -60.05 -34.45 73.42 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.957 -1.09 . . . . 0.0 110.507 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.651 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.2 t-80 -51.09 -39.1 55.31 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.948 -1.095 . . . . 0.0 110.537 -179.484 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -63.19 -55.37 25.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.101 -1.0 . . . . 0.0 109.084 179.328 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.95 -39.23 84.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.23 -0.919 . . . . 0.0 109.199 178.701 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -56.94 -38.18 72.56 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.217 -0.927 . . . . 0.0 110.036 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.836 HG13 ' CD2' ' A' ' 8' ' ' TYR . 90.0 t -58.19 -35.21 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.154 -0.966 . . . . 0.0 110.067 179.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.9 ttmt -52.27 -40.52 61.87 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.969 -1.082 . . . . 0.0 109.952 179.535 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -58.13 -29.95 65.95 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.577 -0.849 . . . . 0.0 110.298 178.96 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -69.2 -52.8 24.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.877 -1.14 . . . . 0.0 110.042 179.909 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.7 p90 -100.35 35.83 2.02 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.138 -0.976 . . . . 0.0 111.083 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -38.08 16.32 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.799 -1.188 . . . . 0.0 110.044 178.921 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -107.47 26.75 9.85 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.1 t90 -106.74 -55.99 2.25 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.966 -1.084 . . . . 0.0 109.893 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 1.3 mtm -128.64 55.43 1.7 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.252 -0.905 . . . . 0.0 109.713 179.711 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 55.8 -163.48 0.15 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.933 -1.104 . . . . 0.0 110.337 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -99.74 48.94 0.93 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.13 -0.981 . . . . 0.0 110.221 179.92 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -140.11 73.06 1.41 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.212 -0.93 . . . . 0.0 109.959 179.736 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.79 73.4 0.62 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.272 -0.892 . . . . 0.0 110.793 -179.823 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -112.51 35.3 3.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.16 -0.962 . . . . 0.0 110.434 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -109.06 -52.72 2.73 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.112 -0.992 . . . . 0.0 109.586 179.289 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.47 -20.93 63.7 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.232 -0.918 . . . . 0.0 111.464 179.335 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.756 HD12 HG11 ' A' ' 34' ' ' VAL . 48.7 mm -74.67 -45.95 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 120.747 -1.221 . . . . 0.0 109.835 179.842 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -65.4 -40.7 93.76 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.229 -0.919 . . . . 0.0 110.067 -179.938 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -58.32 -36.75 73.85 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.147 -0.971 . . . . 0.0 110.532 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m . . . . . 0 N--CA 1.504 2.251 0 O-C-N 121.018 -1.052 . . . . 0.0 110.422 179.91 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt . . . . . 0 N--CA 1.494 1.728 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -111.46 160.87 16.71 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.19 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -143.68 131.15 21.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.161 -0.962 . . . . 0.0 110.375 -179.48 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.0 t -109.93 87.1 2.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.154 -0.967 . . . . 0.0 109.684 179.13 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -50.37 -35.71 29.24 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.11 -0.994 . . . . 0.0 110.937 -179.562 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.843 ' CD2' HG13 ' A' ' 34' ' ' VAL . 25.5 m-85 -61.82 -30.64 70.96 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.084 -1.01 . . . . 0.0 109.919 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.1 m -98.48 0.52 45.3 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.943 -1.098 . . . . 0.0 112.058 179.674 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 52.89 38.08 25.96 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.395 -1.44 . . . . 0.0 110.839 -179.881 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -139.4 168.93 18.71 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.191 -0.943 . . . . 0.0 109.999 179.571 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -121.83 140.27 52.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.175 -0.953 . . . . 0.0 110.886 -179.69 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -106.44 152.63 23.38 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.247 -0.908 . . . . 0.0 109.39 179.302 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.485 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -99.1 -30.71 12.15 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.113 -0.992 . . . . 0.0 111.693 -179.519 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.485 ' CD2' HG23 ' A' ' 14' ' ' THR . 50.3 m-70 -111.46 125.3 53.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.823 -1.173 . . . . 0.0 110.189 179.989 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -110.2 88.53 2.78 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.114 -0.991 . . . . 0.0 109.742 179.679 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -133.24 -179.78 1.17 Allowed Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 109.81 -179.602 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -71.05 -26.97 20.97 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.271 1.142 . . . . 0.0 111.238 179.885 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.0 m -90.17 -40.22 12.35 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.742 -1.224 . . . . 0.0 110.053 179.482 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.6 t -69.04 -48.35 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.06 -1.025 . . . . 0.0 109.699 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -59.06 -51.42 70.1 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.079 -1.013 . . . . 0.0 109.467 179.77 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -59.32 -40.2 85.5 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.163 -0.961 . . . . 0.0 108.891 178.862 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 49.7 m -54.67 -43.02 72.06 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.07 -1.019 . . . . 0.0 108.303 178.301 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -66.09 -40.93 91.19 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.739 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.66 57.15 2.49 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.322 -0.861 . . . . 0.0 110.093 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -113.34 37.97 3.03 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.047 -1.033 . . . . 0.0 110.453 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.12 124.49 1.61 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -53.76 -28.72 36.31 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.157 -1.202 . . . . 0.0 110.27 179.068 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -59.33 -31.24 68.99 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 110.701 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.2 t-80 -48.85 -48.05 42.25 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.927 -1.108 . . . . 0.0 111.175 -179.382 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -58.86 -53.33 59.57 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.053 -1.029 . . . . 0.0 109.37 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.44 -38.98 85.86 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.163 -0.961 . . . . 0.0 109.036 178.556 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -56.46 -38.98 72.4 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.24 -0.912 . . . . 0.0 110.027 179.249 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.843 HG13 ' CD2' ' A' ' 8' ' ' TYR . 97.3 t -60.17 -38.03 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.092 -1.005 . . . . 0.0 109.76 179.747 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 27.3 ttmt -53.65 -39.73 65.28 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.961 -1.087 . . . . 0.0 109.97 179.441 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -58.63 -34.74 71.51 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.209 -0.932 . . . . 0.0 109.997 179.162 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -64.27 -52.47 58.49 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.036 -1.04 . . . . 0.0 109.931 179.867 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.4 p90 -100.6 35.43 2.15 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.118 -0.989 . . . . 0.0 110.991 179.491 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -84.61 -37.71 20.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.8 -1.187 . . . . 0.0 110.267 179.138 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -111.5 21.82 15.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.132 -0.98 . . . . 0.0 111.482 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.7 t90 -60.44 -46.91 88.35 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.861 -1.149 . . . . 0.0 109.963 179.949 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.5 mtm -151.68 36.74 0.57 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.155 -0.965 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 50.9 41.63 27.13 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.011 -1.055 . . . . 0.0 110.899 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.4 -168.03 2.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.162 -0.961 . . . . 0.0 110.318 -179.931 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -117.96 124.86 49.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -125.78 76.7 1.6 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.241 -0.912 . . . . 0.0 110.259 -179.898 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.81 35.71 3.26 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.201 -0.937 . . . . 0.0 110.57 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.3 t -112.77 -55.66 2.5 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.209 -0.932 . . . . 0.0 109.378 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -21.28 64.25 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.225 -0.922 . . . . 0.0 111.064 179.075 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.814 HD12 HG11 ' A' ' 34' ' ' VAL . 47.5 mm -69.92 -41.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.608 -1.307 . . . . 0.0 109.306 179.498 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -71.46 -37.04 71.4 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.19 -0.944 . . . . 0.0 110.327 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -80.3 -36.31 34.53 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.106 -0.996 . . . . 0.0 110.367 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.2 m . . . . . 0 N--CA 1.507 2.416 0 O-C-N 121.08 -1.013 . . . . 0.0 110.339 179.972 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 18.2 mtmt . . . . . 0 N--CA 1.495 1.799 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.9 t80 -107.74 161.36 14.96 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.132 -0.98 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -133.83 134.25 42.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.251 -0.906 . . . . 0.0 110.157 -179.714 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.8 t -114.59 96.51 5.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.154 -0.966 . . . . 0.0 110.158 179.603 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.56 -35.99 61.36 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.985 -1.072 . . . . 0.0 110.385 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.813 ' CD2' HG13 ' A' ' 34' ' ' VAL . 92.6 m-85 -61.24 -32.57 72.37 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.033 -1.042 . . . . 0.0 110.132 179.222 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.4 m -97.08 -4.58 39.25 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.954 -1.091 . . . . 0.0 112.163 -179.982 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.47 39.67 30.3 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.371 -1.456 . . . . 0.0 110.442 -179.698 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.98 171.61 13.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.307 -0.871 . . . . 0.0 110.051 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.437 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 12.9 t80 -118.45 133.21 56.06 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.254 -0.904 . . . . 0.0 110.328 -179.753 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -89.11 165.65 14.36 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.185 -0.947 . . . . 0.0 109.752 179.588 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.453 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.6 t -98.83 -29.92 12.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.134 -0.979 . . . . 0.0 111.698 -179.567 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.744 ' HB2' HG11 ' A' ' 20' ' ' VAL . 46.9 m-70 -111.05 146.36 36.87 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.877 -1.139 . . . . 0.0 110.189 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.11 93.19 3.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.453 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.3 178.69 1.37 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.234 -0.916 . . . . 0.0 110.172 -179.594 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.15 -30.72 15.71 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.442 1.233 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.73 -40.38 12.55 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.996 -1.065 . . . . 0.0 109.988 179.647 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.744 HG11 ' HB2' ' A' ' 15' ' ' HIS . 90.3 t -60.06 -50.46 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.641 179.813 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HD3' ' CE2' ' A' ' 4' ' ' PHE . 19.7 mtt180 -58.86 -50.75 72.85 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.684 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -61.66 -40.29 94.41 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.17 -0.957 . . . . 0.0 108.832 178.817 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -54.53 -43.31 71.81 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.1 -1.0 . . . . 0.0 108.358 178.223 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -62.48 -37.78 87.33 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.008 177.814 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.07 48.35 1.0 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.133 -0.98 . . . . 0.0 110.442 -179.82 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.01 38.02 3.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.118 -0.989 . . . . 0.0 110.241 179.757 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.54 128.17 3.28 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.1 ttm105 -54.61 -28.5 47.05 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.144 -1.209 . . . . 0.0 110.361 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -59.15 -35.56 73.71 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.883 -1.135 . . . . 0.0 110.392 179.772 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.667 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.7 t-80 -51.4 -39.1 56.53 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.023 -1.048 . . . . 0.0 110.5 -179.611 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -62.67 -55.6 25.36 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.136 -0.977 . . . . 0.0 109.128 179.406 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -60.13 -39.25 85.62 Favored 'General case' 0 N--CA 1.509 2.517 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.159 178.807 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -57.36 -37.14 72.15 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.301 -0.875 . . . . 0.0 110.053 179.232 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.974 HG11 HD12 ' A' ' 50' ' ' ILE . 73.0 t -56.86 -37.09 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.022 -1.049 . . . . 0.0 110.156 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.8 ttpt -54.13 -40.79 67.71 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.913 -1.117 . . . . 0.0 109.718 179.445 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.95 -28.63 66.46 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.359 178.911 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.74 -53.11 16.79 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.888 -1.132 . . . . 0.0 110.134 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.7 p90 -99.91 32.66 2.83 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.208 -0.933 . . . . 0.0 111.294 179.625 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -74.17 -35.97 64.05 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.73 -1.231 . . . . 0.0 110.258 179.184 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -107.28 27.0 9.51 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.121 -0.987 . . . . 0.0 111.091 179.61 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.448 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 10.6 t90 -109.45 -55.81 2.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.055 -1.028 . . . . 0.0 110.047 179.922 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.48 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 3.7 mtm -141.58 57.73 1.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.224 -0.923 . . . . 0.0 109.889 179.67 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -51.18 -36.21 40.0 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.056 -1.027 . . . . 0.0 110.97 -179.711 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -53.36 -58.69 6.22 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.966 -1.084 . . . . 0.0 110.511 -179.852 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.82 87.46 1.92 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.161 -0.962 . . . . 0.0 110.155 179.892 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -130.49 71.5 1.46 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.156 -0.965 . . . . 0.0 110.546 -179.888 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -144.3 34.89 1.2 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.162 -0.961 . . . . 0.0 110.573 179.426 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -53.42 2.65 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.204 -0.935 . . . . 0.0 109.393 179.192 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.24 65.04 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 111.249 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.974 HD12 HG11 ' A' ' 34' ' ' VAL . 51.1 mm -76.85 -51.97 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 120.647 -1.283 . . . . 0.0 109.787 179.806 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.2 -39.66 91.04 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.239 -0.913 . . . . 0.0 110.116 179.884 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -57.12 -37.69 72.34 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.072 -1.018 . . . . 0.0 110.507 -179.794 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.9 m . . . . . 0 N--CA 1.503 2.185 0 O-C-N 121.067 -1.021 . . . . 0.0 110.347 179.96 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.7 mttt . . . . . 0 N--CA 1.501 2.109 0 CA-C-O 120.846 0.355 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -123.78 162.38 23.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.15 -0.969 . . . . 0.0 110.308 -179.441 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -138.15 134.19 34.26 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.205 -0.935 . . . . 0.0 110.47 -179.603 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.2 t -112.86 94.2 4.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.215 -0.928 . . . . 0.0 109.975 179.475 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -51.9 -36.05 47.48 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 121.068 -1.02 . . . . 0.0 110.569 179.95 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.84 ' CD2' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -61.2 -32.07 71.83 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.184 -0.947 . . . . 0.0 110.163 179.225 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.9 m -98.74 -4.38 33.62 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.073 -1.017 . . . . 0.0 112.358 -179.864 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.57 38.71 28.81 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.33 -1.481 . . . . 0.0 110.568 -179.642 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -139.61 170.9 15.05 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 109.637 179.785 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -117.77 135.6 53.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.16 -0.963 . . . . 0.0 110.695 -179.592 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -100.82 133.36 45.42 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.174 -0.954 . . . . 0.0 109.483 179.391 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.2 t -75.87 -24.08 55.67 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.187 -0.945 . . . . 0.0 111.881 -179.392 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.836 ' HB2' HG11 ' A' ' 20' ' ' VAL . 46.8 m-70 -110.93 137.8 48.11 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.761 -1.212 . . . . 0.0 110.428 -179.842 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -125.51 85.99 2.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.671 179.659 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.04 179.69 1.3 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.268 -0.895 . . . . 0.0 109.906 -179.496 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.446 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.01 -31.7 14.57 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.329 1.173 . . . . 0.0 110.896 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.5 m -86.13 -46.57 10.31 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.876 -1.14 . . . . 0.0 109.752 179.305 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.2 t -59.54 -52.72 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.164 -0.96 . . . . 0.0 109.687 179.739 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -56.39 -52.41 64.7 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.025 -1.047 . . . . 0.0 109.634 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -60.62 -39.9 89.89 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.941 178.82 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.1 m -55.31 -43.53 74.94 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.044 -1.035 . . . . 0.0 108.313 178.272 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -62.67 -38.87 92.03 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.845 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.15 50.03 1.07 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.318 -0.864 . . . . 0.0 110.399 -179.922 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.33 37.47 3.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -0.987 . . . . 0.0 110.336 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.18 127.16 2.78 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.94 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.27 -28.65 43.24 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.123 -1.222 . . . . 0.0 110.331 179.092 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -59.18 -33.36 70.85 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 120.949 -1.094 . . . . 0.0 110.57 179.735 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.603 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.58 -39.63 50.13 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.979 -1.076 . . . . 0.0 110.803 -179.545 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -54.77 33.15 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.118 -0.988 . . . . 0.0 109.127 179.368 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.84 -39.16 88.04 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.203 -0.936 . . . . 0.0 109.052 178.693 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -56.27 -37.29 69.6 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.209 -0.932 . . . . 0.0 110.103 179.057 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.84 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.0 t -55.1 -36.24 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.062 -1.024 . . . . 0.0 110.099 179.609 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 30.9 tttt -54.75 -40.9 69.79 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.928 -1.107 . . . . 0.0 109.714 179.328 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.77 -28.02 65.54 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.372 178.975 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -72.29 -52.79 14.69 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.869 -1.145 . . . . 0.0 110.314 -179.966 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 36.8 p90 -99.28 31.12 3.2 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.11 -0.994 . . . . 0.0 111.5 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.85 -39.53 66.46 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.708 -1.245 . . . . 0.0 110.014 179.251 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -118.81 26.07 9.8 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.265 -0.897 . . . . 0.0 111.235 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 22.8 t90 -69.54 -42.49 74.57 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.962 -1.086 . . . . 0.0 110.078 -179.88 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.498 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.0 ttm -151.09 40.63 0.72 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.166 -0.959 . . . . 0.0 110.532 -179.974 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 52.57 -172.05 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.946 -1.096 . . . . 0.0 110.734 179.869 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 53.56 -172.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.102 -0.999 . . . . 0.0 110.67 -179.957 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -114.24 130.69 56.63 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.231 -0.918 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -120.19 75.29 1.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.291 -0.88 . . . . 0.0 110.114 -179.981 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.54 37.11 2.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.118 -0.989 . . . . 0.0 110.4 179.703 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.1 m -113.91 -55.34 2.51 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.153 -0.967 . . . . 0.0 109.687 179.485 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.03 -21.41 63.58 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.208 -0.933 . . . . 0.0 111.5 179.469 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.469 HD12 HG11 ' A' ' 34' ' ' VAL . 44.8 mm -67.21 -41.73 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.568 -1.332 . . . . 0.0 109.424 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.91 -39.81 95.03 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 179.887 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -66.78 -36.43 82.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.148 -0.97 . . . . 0.0 110.33 179.856 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.7 m . . . . . 0 N--CA 1.504 2.27 0 O-C-N 121.071 -1.018 . . . . 0.0 110.088 179.747 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.1 mtmt . . . . . 0 N--CA 1.493 1.684 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.642 ' HD1' HD13 ' A' ' 13' ' ' LEU . 89.4 t80 -114.91 162.04 17.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.126 -0.984 . . . . 0.0 110.405 -179.51 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -137.25 133.05 34.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.243 -0.911 . . . . 0.0 110.01 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 t -112.2 93.21 4.34 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.118 179.475 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -52.29 -36.03 51.87 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 121.026 -1.046 . . . . 0.0 110.367 179.813 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.859 ' CD2' HG13 ' A' ' 34' ' ' VAL . 85.4 m-85 -60.28 -30.88 69.74 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.205 -0.935 . . . . 0.0 110.196 178.982 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.1 m -100.81 -2.08 33.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.012 -1.055 . . . . 0.0 112.275 -179.713 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.88 38.34 26.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.407 -1.433 . . . . 0.0 110.664 -179.653 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -140.2 168.45 19.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.213 -0.929 . . . . 0.0 109.762 179.737 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -118.34 142.59 47.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.2 -0.938 . . . . 0.0 110.619 -179.524 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.642 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.5 mp -101.37 160.64 14.25 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.211 -0.931 . . . . 0.0 109.769 179.465 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.526 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -102.51 -30.35 11.03 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.191 -0.943 . . . . 0.0 112.045 -179.286 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.617 ' O ' HG11 ' A' ' 20' ' ' VAL . 48.1 m-70 -113.57 111.76 22.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.79 -1.194 . . . . 0.0 110.533 -179.597 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -92.95 67.17 4.3 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.162 -0.961 . . . . 0.0 110.468 179.837 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -107.39 178.14 1.15 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.155 -0.966 . . . . 0.0 110.009 179.684 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.39 -30.7 15.07 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.332 1.175 . . . . 0.0 111.276 -179.816 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 m -86.89 -41.13 14.24 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.86 -1.15 . . . . 0.0 110.122 179.865 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.617 HG11 ' O ' ' A' ' 15' ' ' HIS . 88.7 t -58.45 -57.04 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 O-C-N 121.073 -1.017 . . . . 0.0 109.914 179.893 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -53.69 -50.21 66.35 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.947 -1.095 . . . . 0.0 110.094 -179.824 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -62.97 -41.07 99.44 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.741 178.781 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.05 -43.35 73.72 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.234 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -63.12 -38.49 91.37 Favored 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.832 177.908 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 t -97.6 49.55 1.04 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.366 -179.894 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -117.38 37.79 3.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.06 -1.025 . . . . 0.0 110.375 179.853 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.11 127.27 2.82 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.792 -1.323 . . . . 0.0 109.792 -179.906 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -54.35 -28.59 43.92 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.151 -1.205 . . . . 0.0 110.323 179.064 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -59.36 -33.63 71.4 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.982 -1.073 . . . . 0.0 110.53 179.764 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.5 t-80 -50.5 -38.71 45.71 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.98 -1.075 . . . . 0.0 110.793 -179.477 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -62.88 -55.63 24.39 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.165 -0.96 . . . . 0.0 109.153 179.31 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -59.4 -38.56 80.89 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.232 -0.917 . . . . 0.0 109.215 178.661 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.27 -38.26 70.95 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.204 -0.935 . . . . 0.0 110.116 179.327 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.859 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.9 t -58.03 -35.25 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.578 0 O-C-N 121.027 -1.045 . . . . 0.0 110.152 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 22.1 tttt -52.59 -40.58 62.78 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 121.006 -1.059 . . . . 0.0 110.075 179.613 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -57.94 -28.2 64.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.279 -0.888 . . . . 0.0 110.532 178.971 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -71.88 -52.37 17.67 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.856 -1.153 . . . . 0.0 110.386 -179.882 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 39.8 p90 -99.49 34.1 2.3 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.033 -1.042 . . . . 0.0 111.479 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -80.35 -39.88 27.73 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.758 -1.214 . . . . 0.0 110.074 179.035 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -117.75 34.64 5.05 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.202 -0.936 . . . . 0.0 110.533 179.711 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -92.21 -48.28 6.78 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.122 -0.986 . . . . 0.0 110.539 -179.751 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 tpp -146.02 -60.83 0.32 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.146 -0.971 . . . . 0.0 110.823 -179.785 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -121.8 -175.84 3.19 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.074 -1.016 . . . . 0.0 110.607 -179.603 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -99.89 -37.14 9.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.197 -0.939 . . . . 0.0 110.976 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -104.79 78.83 1.47 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.917 -1.115 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -116.46 74.76 0.92 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.213 -0.929 . . . . 0.0 110.011 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.9 35.06 3.37 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.206 -0.933 . . . . 0.0 110.673 179.843 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 m -109.8 -54.5 2.55 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.173 -0.954 . . . . 0.0 109.254 179.084 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.72 -20.92 64.02 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.266 -0.896 . . . . 0.0 111.313 179.184 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.539 HD12 HG11 ' A' ' 34' ' ' VAL . 47.2 mm -72.72 -40.71 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 120.701 -1.249 . . . . 0.0 109.663 179.703 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -74.06 -40.76 62.57 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.196 -0.94 . . . . 0.0 109.911 179.919 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -58.33 -34.41 70.58 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.211 -0.93 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.6 m . . . . . 0 N--CA 1.505 2.293 0 O-C-N 121.014 -1.054 . . . . 0.0 110.263 -179.942 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.7 mttt . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.609 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.8 t80 -112.08 161.51 16.42 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.207 -179.931 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -136.72 132.38 34.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.237 -0.914 . . . . 0.0 110.183 -179.573 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.0 t -111.97 94.46 4.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.095 -1.003 . . . . 0.0 110.083 179.526 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.08 -35.82 48.84 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.133 -0.979 . . . . 0.0 110.538 179.901 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.883 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.1 m-85 -61.6 -33.36 73.77 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.104 -0.997 . . . . 0.0 110.001 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.3 m -96.12 -3.43 44.58 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.102 -0.999 . . . . 0.0 112.176 179.968 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 52.68 39.33 28.26 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.379 -1.451 . . . . 0.0 110.538 -179.72 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.44 172.72 12.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.942 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -118.89 139.08 52.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.281 -0.887 . . . . 0.0 110.611 -179.62 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.609 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -99.08 168.24 10.2 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.209 -0.932 . . . . 0.0 109.626 179.462 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.79 -30.47 12.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.122 -0.986 . . . . 0.0 111.6 -179.601 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 45.2 m-70 -114.85 147.73 39.5 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.892 -1.13 . . . . 0.0 110.214 -179.89 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -126.55 90.6 3.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.197 -0.939 . . . . 0.0 109.801 179.94 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.447 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.32 178.32 1.48 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.227 -0.92 . . . . 0.0 110.177 -179.708 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 41.7 Cg_endo -70.12 -31.35 19.08 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.448 1.236 . . . . 0.0 110.802 179.856 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.41 -36.97 23.84 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.056 -1.027 . . . . 0.0 110.057 179.283 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 79.4 t -72.97 -48.81 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 121.029 -1.044 . . . . 0.0 109.821 179.677 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 21.6 mtm180 -57.27 -52.26 66.06 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.072 -1.018 . . . . 0.0 109.764 179.951 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -59.17 -39.52 82.76 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.13 -0.982 . . . . 0.0 109.203 179.056 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.3 m -55.98 -43.44 77.58 Favored 'General case' 0 N--CA 1.511 2.62 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.237 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -63.04 -40.27 97.21 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.889 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.6 55.83 2.27 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.395 -0.815 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.2 37.34 4.03 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.122 -0.986 . . . . 0.0 110.371 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.6 127.3 2.69 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.932 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -28.11 47.31 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.116 -1.226 . . . . 0.0 110.344 179.138 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -60.3 -33.18 71.99 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.939 -1.101 . . . . 0.0 110.626 179.775 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.95 -37.91 34.16 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.955 -1.091 . . . . 0.0 110.781 -179.662 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -62.61 -56.41 18.1 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.086 -1.008 . . . . 0.0 109.166 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.04 -38.59 79.68 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.223 -0.923 . . . . 0.0 109.156 178.764 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -56.59 -37.86 71.21 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 110.035 179.28 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.883 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.5 t -57.99 -36.34 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.127 -0.983 . . . . 0.0 109.982 179.756 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.7 ttpm? -54.89 -42.29 71.95 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.921 -1.112 . . . . 0.0 109.611 179.488 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.08 -28.33 64.48 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.298 -0.876 . . . . 0.0 110.373 178.899 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -70.23 -52.28 24.35 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.915 -1.116 . . . . 0.0 110.292 -179.841 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.4 p90 -99.77 34.39 2.28 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.096 -1.003 . . . . 0.0 111.358 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.71 -37.28 24.95 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.714 -1.241 . . . . 0.0 110.154 178.83 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -110.32 29.43 7.69 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 179.587 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.1 t90 -90.77 -40.23 11.93 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.014 -1.054 . . . . 0.0 109.973 179.878 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -154.89 -66.46 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.199 -0.938 . . . . 0.0 110.483 179.84 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -124.26 -164.34 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.196 -0.94 . . . . 0.0 110.09 179.971 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -126.9 38.71 4.05 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.104 -0.997 . . . . 0.0 110.378 179.725 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -159.13 75.05 0.67 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.224 -0.922 . . . . 0.0 110.504 179.886 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.17 82.96 1.96 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.137 -0.977 . . . . 0.0 110.349 -179.837 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -109.34 36.08 3.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.119 -0.988 . . . . 0.0 110.33 179.617 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.5 m -115.05 -55.55 2.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.088 -1.007 . . . . 0.0 109.608 179.416 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -22.31 61.97 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.222 -0.924 . . . . 0.0 111.153 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.661 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -66.39 -39.85 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 120.646 -1.284 . . . . 0.0 109.291 179.191 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -72.35 -36.16 68.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.226 -0.921 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -76.48 -35.6 58.31 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.036 -1.04 . . . . 0.0 110.615 179.93 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m . . . . . 0 N--CA 1.508 2.434 0 O-C-N 121.053 -1.029 . . . . 0.0 110.136 179.944 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HB2' ' OH ' ' A' ' 12' ' ' TYR . 32.4 mttm . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.579 ' HD2' HD13 ' A' ' 13' ' ' LEU . 73.9 t80 -113.1 161.86 16.61 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.082 -1.011 . . . . 0.0 110.292 -179.626 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -131.59 137.46 48.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.237 -0.914 . . . . 0.0 110.232 -179.82 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.08 97.9 6.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.145 -0.972 . . . . 0.0 109.989 179.512 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -51.93 -35.95 47.48 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.061 -1.025 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.841 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.8 m-85 -63.19 -32.26 73.61 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.091 -1.006 . . . . 0.0 110.167 179.38 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.8 m -98.2 -8.94 26.47 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.058 -1.026 . . . . 0.0 112.024 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 54.87 41.0 32.25 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.344 -1.472 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.09 173.28 11.66 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.246 -0.909 . . . . 0.0 110.025 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.444 ' OH ' ' HB2' ' A' ' 3' ' ' LYS . 5.1 t80 -120.08 131.52 55.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.577 -179.6 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.579 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.1 mp -88.84 170.45 10.72 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.143 -0.973 . . . . 0.0 109.7 179.48 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.5 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.2 t -96.93 -31.29 12.63 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.302 -0.873 . . . . 0.0 111.375 -179.83 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.724 ' HB2' HG11 ' A' ' 20' ' ' VAL . 50.4 m-70 -112.24 146.75 37.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.824 -1.173 . . . . 0.0 110.125 179.916 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -126.27 93.96 3.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 109.861 179.919 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.456 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -148.63 178.47 1.45 Allowed Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.182 -0.949 . . . . 0.0 110.312 -179.533 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.46 -32.87 14.9 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.384 1.202 . . . . 0.0 110.852 179.873 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.8 m -83.99 -39.87 19.16 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.965 -1.085 . . . . 0.0 109.839 179.396 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.724 HG11 ' HB2' ' A' ' 15' ' ' HIS . 58.4 t -65.74 -47.39 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 O-C-N 121.081 -1.012 . . . . 0.0 109.642 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -57.19 -50.83 71.61 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.127 -0.983 . . . . 0.0 109.565 179.777 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -61.48 -40.96 96.46 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.22 -0.925 . . . . 0.0 108.732 178.803 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -54.19 -43.22 70.54 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.178 -0.951 . . . . 0.0 108.524 178.33 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -62.33 -37.71 86.67 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.348 -0.845 . . . . 0.0 108.853 178.076 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -96.58 51.66 1.18 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.202 -0.936 . . . . 0.0 110.317 -179.861 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m -117.1 37.64 3.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.28 128.34 3.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.919 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -28.61 45.54 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.136 -1.214 . . . . 0.0 110.351 179.172 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -59.37 -34.9 72.97 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.029 -1.044 . . . . 0.0 110.393 179.764 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.578 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.22 -39.01 55.63 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.961 -1.087 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -61.9 -55.09 33.29 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.114 179.27 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -38.84 83.6 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.217 -0.927 . . . . 0.0 109.193 178.65 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.35 -36.96 71.85 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.091 -1.005 . . . . 0.0 110.203 179.156 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.958 HG11 HD12 ' A' ' 50' ' ' ILE . 72.2 t -57.85 -35.39 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.08 -1.012 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.8 mmmt -52.65 -39.44 61.81 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.877 -1.14 . . . . 0.0 109.957 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.44 -28.82 65.64 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 178.9 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -73.28 -54.11 9.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.853 -1.154 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 31.6 p90 -98.56 31.73 2.78 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.088 -1.008 . . . . 0.0 111.508 179.88 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.88 -38.41 64.4 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.739 -1.226 . . . . 0.0 109.777 178.948 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.4 22.58 13.95 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.253 -0.904 . . . . 0.0 111.114 179.176 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.525 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.3 t90 -101.5 -49.31 4.07 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.908 -1.12 . . . . 0.0 109.804 179.662 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.525 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 28.2 mmt -111.98 -53.02 2.75 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.245 -0.91 . . . . 0.0 110.245 179.701 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 54.79 39.31 31.33 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.986 -1.071 . . . . 0.0 110.674 179.99 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -149.04 -66.29 0.23 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.179 -0.95 . . . . 0.0 110.439 179.888 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -166.89 77.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.193 -0.942 . . . . 0.0 110.851 -179.982 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.42 73.4 1.53 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.233 -0.917 . . . . 0.0 110.301 -179.799 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.09 33.62 5.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.162 -0.962 . . . . 0.0 110.524 179.445 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.1 p -107.27 -50.82 3.01 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.096 -1.002 . . . . 0.0 109.678 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.36 -21.84 60.45 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.219 -0.926 . . . . 0.0 111.527 179.369 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.958 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -76.66 -39.72 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 120.716 -1.24 . . . . 0.0 109.925 179.777 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -80.39 -40.72 25.97 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.153 -0.967 . . . . 0.0 109.958 179.758 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -58.06 -33.24 68.82 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -0.91 . . . . 0.0 110.685 179.816 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.4 m . . . . . 0 N--CA 1.505 2.309 0 O-C-N 120.997 -1.064 . . . . 0.0 110.109 179.945 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 34.7 mttt . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 120.637 0.256 . . . . 0.0 110.561 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.564 ' HD2' HD13 ' A' ' 13' ' ' LEU . 57.3 t80 -112.69 155.28 24.77 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.213 -0.93 . . . . 0.0 109.816 179.552 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -134.28 139.55 45.8 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.158 -0.964 . . . . 0.0 110.532 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.0 t -111.34 98.39 7.45 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.258 -0.901 . . . . 0.0 110.185 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -53.52 -35.79 61.05 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.148 -0.97 . . . . 0.0 110.462 179.72 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.85 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.1 m-85 -63.01 -33.12 74.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.105 -0.997 . . . . 0.0 110.306 179.44 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.4 m -98.75 -2.83 37.13 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.005 -1.059 . . . . 0.0 112.082 179.855 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 53.8 37.98 27.57 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.37 -1.456 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -131.32 171.66 13.08 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.168 -0.957 . . . . 0.0 109.98 179.697 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.412 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -125.06 107.64 11.01 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.905 . . . . 0.0 110.12 179.852 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.564 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.6 mp -67.31 166.74 13.74 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.167 -0.958 . . . . 0.0 109.854 -179.999 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.19 -30.42 11.93 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.266 -0.896 . . . . 0.0 111.628 -179.694 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CD2' HG23 ' A' ' 14' ' ' THR . 42.0 m-70 -115.85 139.76 49.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.819 -1.175 . . . . 0.0 110.184 -179.897 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -116.02 92.04 3.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.255 -0.903 . . . . 0.0 109.901 179.746 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.44 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -137.83 177.92 1.92 Allowed Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 -179.637 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.44 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.7 Cg_endo -70.32 -31.41 18.09 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.364 1.191 . . . . 0.0 110.974 179.995 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -43.78 11.72 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.972 -1.08 . . . . 0.0 109.842 179.501 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 15' ' ' HIS . 92.8 t -60.12 -49.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.636 179.842 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtp-105 -59.61 -50.85 72.26 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.038 -1.039 . . . . 0.0 109.332 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.07 -39.96 91.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.214 -0.929 . . . . 0.0 108.85 178.821 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.9 m -54.37 -42.84 70.79 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.057 -1.027 . . . . 0.0 108.611 178.32 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -62.73 -37.47 86.69 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 119.63 -0.828 . . . . 0.0 109.109 178.066 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.8 49.54 1.09 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.156 -0.965 . . . . 0.0 110.529 -179.727 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.89 40.31 2.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.096 -1.002 . . . . 0.0 109.782 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.37 148.96 19.95 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.666 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -79.64 -9.11 59.58 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.298 -1.119 . . . . 0.0 111.064 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -91.47 -21.34 20.97 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.678 -1.264 . . . . 0.0 111.449 179.657 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.9 t-80 -48.49 -37.52 17.67 Favored 'General case' 0 N--CA 1.518 2.953 0 O-C-N 120.743 -1.223 . . . . 0.0 110.968 -179.559 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -63.11 -54.26 40.71 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.092 -1.005 . . . . 0.0 108.981 179.241 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.26 -39.2 85.99 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.0 178.609 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.88 -37.37 68.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.167 -0.958 . . . . 0.0 110.103 179.218 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.85 HG13 ' CD2' ' A' ' 8' ' ' TYR . 69.4 t -56.13 -35.34 41.59 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 O-C-N 120.993 -1.067 . . . . 0.0 110.066 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.5 tptm -52.4 -39.93 61.5 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.905 -1.122 . . . . 0.0 110.056 179.562 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.67 -29.6 64.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -69.96 -53.04 19.56 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.901 -1.124 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.455 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -100.0 34.76 2.21 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.124 -0.985 . . . . 0.0 111.227 179.793 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.08 -35.86 23.44 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.744 -1.222 . . . . 0.0 110.3 178.978 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -105.17 23.23 13.99 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.043 -1.035 . . . . 0.0 111.289 179.553 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.519 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 14.9 t90 -99.76 -45.28 5.8 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.855 -1.153 . . . . 0.0 110.152 179.89 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.519 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -124.34 42.18 3.32 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.125 -0.984 . . . . 0.0 110.094 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.12 -75.46 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.294 -0.878 . . . . 0.0 110.919 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -168.97 44.36 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.775 -1.203 . . . . 0.0 111.124 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -147.47 75.38 1.36 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 179.954 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -155.93 74.57 0.86 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.25 -0.906 . . . . 0.0 110.74 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -118.43 36.62 4.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.178 -0.951 . . . . 0.0 110.518 179.676 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -113.22 -54.94 2.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.183 -0.948 . . . . 0.0 109.721 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.55 63.54 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.288 -0.883 . . . . 0.0 111.328 179.405 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.784 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -68.88 -40.93 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 120.693 -1.255 . . . . 0.0 109.464 179.597 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.75 -41.35 17.72 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.17 -0.956 . . . . 0.0 109.76 179.663 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -60.86 -32.41 71.83 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.288 -0.883 . . . . 0.0 110.457 179.676 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 83.3 m . . . . . 0 N--CA 1.504 2.253 0 O-C-N 120.977 -1.077 . . . . 0.0 110.323 -179.975 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 12' ' ' TYR . 91.4 mttt . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 . . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 13' ' ' LEU . 44.7 t80 -104.57 148.85 26.05 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.3 -0.875 . . . . 0.0 109.465 179.47 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -125.08 130.15 51.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.2 -0.938 . . . . 0.0 110.542 -179.407 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.0 t -109.98 93.87 4.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.182 -0.949 . . . . 0.0 109.686 179.375 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -51.74 -36.41 47.04 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 121.158 -0.964 . . . . 0.0 111.035 -179.427 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.882 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.053 -1.029 . . . . 0.0 110.114 179.461 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -96.42 -4.23 42.12 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.002 -1.061 . . . . 0.0 111.952 179.605 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 53.68 47.25 24.21 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.428 -1.42 . . . . 0.0 110.66 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 t -140.95 171.26 14.32 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.265 -0.897 . . . . 0.0 110.373 179.852 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE2' ' CD ' ' A' ' 3' ' ' LYS . 12.1 t80 -126.66 104.68 8.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.991 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.678 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.4 mp -65.22 163.48 15.16 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.868 -179.739 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.491 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -99.3 -31.05 11.89 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.199 -0.938 . . . . 0.0 111.591 -179.611 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.491 ' CD2' HG23 ' A' ' 14' ' ' THR . 42.0 m-70 -114.23 136.42 52.98 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.823 -1.173 . . . . 0.0 110.076 180.0 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -114.31 92.09 3.84 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.155 -0.966 . . . . 0.0 109.849 179.66 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.433 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.12 179.04 1.47 Allowed Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.232 -0.918 . . . . 0.0 109.983 -179.601 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.16 -30.84 15.52 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.293 1.154 . . . . 0.0 111.028 179.994 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.1 m -89.27 -43.73 10.76 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.942 -1.099 . . . . 0.0 109.887 179.607 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.9 t -59.26 -52.48 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.58 0 O-C-N 121.121 -0.987 . . . . 0.0 109.833 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 mtp-105 -58.2 -50.08 74.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.135 -0.978 . . . . 0.0 109.511 179.817 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt -61.47 -40.06 93.16 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.291 -0.963 . . . . 0.0 108.88 178.72 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 m -54.29 -43.03 70.71 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.109 -0.994 . . . . 0.0 108.539 178.269 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -62.7 -37.91 88.34 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.96 177.961 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.92 52.09 1.15 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.178 -0.952 . . . . 0.0 110.188 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.37 38.05 3.36 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.051 -1.031 . . . . 0.0 110.392 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.78 126.47 2.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.976 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -53.95 -28.72 38.98 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.107 -1.231 . . . . 0.0 110.378 179.217 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -60.4 -31.54 70.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 0.0 110.645 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.535 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.3 t-80 -49.52 -37.97 28.86 Favored 'General case' 0 N--CA 1.516 2.832 0 O-C-N 120.933 -1.105 . . . . 0.0 110.964 -179.564 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -62.23 -54.23 43.78 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.072 -1.018 . . . . 0.0 109.118 179.3 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.38 -38.43 83.89 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.123 178.612 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -56.57 -37.65 70.87 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.274 -0.891 . . . . 0.0 110.18 179.321 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.908 HG11 HD12 ' A' ' 50' ' ' ILE . 95.1 t -59.62 -39.32 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.123 -0.986 . . . . 0.0 109.722 179.645 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 52.3 mttt -54.06 -40.91 67.59 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.016 -1.052 . . . . 0.0 109.606 179.331 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.42 -34.92 69.44 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.052 178.993 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -62.15 -52.56 63.36 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.002 -1.061 . . . . 0.0 109.602 179.649 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 49.8 p90 -100.94 38.0 1.63 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.276 -0.89 . . . . 0.0 110.781 179.412 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -87.0 -37.35 17.6 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.927 -1.108 . . . . 0.0 110.067 178.874 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.35 19.25 14.7 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.179 -0.951 . . . . 0.0 111.179 179.244 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.6 t90 -105.86 -55.98 2.25 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.809 -1.182 . . . . 0.0 109.971 179.704 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 5.1 tpp -143.14 57.98 1.4 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.864 . . . . 0.0 109.855 179.963 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.22 89.23 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.525 0 O-C-N 121.206 -0.934 . . . . 0.0 110.254 -179.69 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.08 -58.73 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.249 -0.907 . . . . 0.0 110.733 179.891 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -159.71 76.32 0.65 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.302 -0.873 . . . . 0.0 110.722 179.868 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.15 71.0 1.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.182 -0.949 . . . . 0.0 110.386 -179.816 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.67 32.81 5.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.174 -0.954 . . . . 0.0 110.657 179.406 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -104.07 -48.67 3.82 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.08 -1.012 . . . . 0.0 109.568 179.297 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -21.25 62.78 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.169 -0.957 . . . . 0.0 111.469 179.491 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.908 HD12 HG11 ' A' ' 34' ' ' VAL . 50.3 mm -82.12 -53.11 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 120.646 -1.284 . . . . 0.0 109.945 179.728 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -56.88 -39.57 74.6 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.135 -0.978 . . . . 0.0 110.32 -179.855 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -57.14 -36.57 70.87 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.148 -0.97 . . . . 0.0 110.54 -179.922 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m . . . . . 0 N--CA 1.505 2.3 0 O-C-N 121.074 -1.016 . . . . 0.0 110.483 179.948 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 20.3 mtmt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 21' ' ' ARG . 40.7 t80 -113.53 154.42 27.13 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.286 -0.884 . . . . 0.0 109.609 179.564 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -126.45 133.82 51.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.053 -1.029 . . . . 0.0 110.538 -179.851 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 45.9 t -109.8 97.7 7.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.502 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -54.32 -36.57 63.89 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.094 -1.004 . . . . 0.0 110.272 179.715 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.0 m-85 -59.84 -32.37 70.61 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.185 179.082 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.426 ' CB ' HG22 ' A' ' 11' ' ' THR . 33.8 m -97.02 -1.81 44.7 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.984 -1.073 . . . . 0.0 112.098 -179.894 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.63 39.17 27.79 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.352 -1.468 . . . . 0.0 110.399 -179.589 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 9' ' ' CYS . 9.3 t -145.83 175.31 10.51 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -122.03 122.67 39.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.363 -0.835 . . . . 0.0 110.285 -179.624 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.627 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.2 mp -76.44 170.41 16.42 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.101 -0.999 . . . . 0.0 109.506 179.283 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.479 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -100.15 -29.4 12.51 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.173 -0.954 . . . . 0.0 111.799 -179.661 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.721 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.1 m-70 -110.94 146.53 36.43 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.758 -1.214 . . . . 0.0 110.388 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -125.38 93.68 3.93 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.772 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.75 176.7 2.08 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.25 -0.906 . . . . 0.0 110.27 -179.611 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -69.59 -32.08 19.99 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.401 1.211 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -86.05 -39.5 16.74 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.954 -1.091 . . . . 0.0 109.973 179.5 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 15' ' ' HIS . 75.7 t -63.38 -47.39 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.208 -0.932 . . . . 0.0 109.595 179.751 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 mtt180 -58.29 -51.64 68.94 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.082 -1.011 . . . . 0.0 109.632 179.941 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -62.29 -41.13 98.24 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.789 179.012 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.8 m -55.68 -43.17 76.11 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.074 -1.016 . . . . 0.0 108.522 178.324 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.627 ' ND1' HD21 ' A' ' 13' ' ' LEU . 72.3 t60 -61.83 -35.35 77.98 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.644 -0.823 . . . . 0.0 109.288 178.02 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -98.92 44.42 1.03 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.051 -1.03 . . . . 0.0 110.651 -179.795 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m -116.76 39.75 3.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.117 -0.989 . . . . 0.0 109.749 179.626 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.38 163.54 21.88 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -179.667 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -89.18 -11.72 42.97 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.281 -1.129 . . . . 0.0 110.842 178.689 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.69 -26.18 19.69 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.729 -1.232 . . . . 0.0 111.087 179.659 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.717 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.1 t-80 -50.67 -39.58 51.37 Favored 'General case' 0 N--CA 1.516 2.858 0 O-C-N 120.737 -1.227 . . . . 0.0 110.546 -179.577 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -64.13 -54.37 34.83 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.945 179.17 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -60.81 -39.53 89.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.116 178.588 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.2 -38.04 73.09 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.261 -0.899 . . . . 0.0 109.988 179.194 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.728 HG11 HD12 ' A' ' 50' ' ' ILE . 78.9 t -56.81 -37.76 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 121.036 -1.04 . . . . 0.0 109.964 179.703 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.5 ttpp -54.87 -41.24 70.6 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.966 -1.084 . . . . 0.0 109.716 179.435 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.64 -32.0 68.66 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.868 . . . . 0.0 110.15 178.963 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -67.66 -52.29 39.74 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.093 -1.004 . . . . 0.0 110.158 179.899 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.64 ' HE1' HG12 ' A' ' 34' ' ' VAL . 44.2 p90 -100.22 33.12 2.75 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.12 -0.987 . . . . 0.0 111.33 179.622 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -79.49 -36.89 37.97 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.755 -1.216 . . . . 0.0 110.144 179.026 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -112.78 31.41 6.4 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.172 -0.955 . . . . 0.0 110.984 179.833 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.5 t90 -84.33 -38.94 19.75 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.085 -1.01 . . . . 0.0 110.219 179.925 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.446 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -153.72 -65.26 0.15 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.121 -0.987 . . . . 0.0 110.674 179.983 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.4 -164.64 1.51 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.19 -0.944 . . . . 0.0 110.15 -179.736 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -112.58 39.01 2.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.191 -0.943 . . . . 0.0 110.303 179.877 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -151.17 73.73 1.11 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.167 -0.958 . . . . 0.0 110.43 179.874 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.11 70.64 1.37 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.219 -0.926 . . . . 0.0 110.217 -179.945 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.85 34.56 4.75 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.224 -0.922 . . . . 0.0 110.516 179.646 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.4 m -107.28 -53.05 2.67 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.152 -0.967 . . . . 0.0 109.243 179.184 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.04 -21.37 63.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.244 -0.91 . . . . 0.0 111.225 179.203 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.728 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.56 -54.87 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.604 -1.31 . . . . 0.0 109.534 179.603 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.61 -40.97 93.8 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.798 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -58.69 -35.82 73.24 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.175 -0.953 . . . . 0.0 110.333 179.782 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m . . . . . 0 N--CA 1.506 2.347 0 O-C-N 120.995 -1.065 . . . . 0.0 110.308 179.717 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.461 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 16.2 mtmm . . . . . 0 N--CA 1.503 2.183 0 CA-C-O 120.877 0.37 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.462 ' CD1' HD13 ' A' ' 13' ' ' LEU . 63.7 t80 -54.0 159.16 1.86 Allowed 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.083 -1.01 . . . . 0.0 111.049 -179.493 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -141.71 130.91 23.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.887 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.5 t -113.39 92.36 3.97 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.095 -1.003 . . . . 0.0 110.449 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -53.57 -35.69 61.07 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.024 -1.048 . . . . 0.0 110.233 179.482 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 34' ' ' VAL . 86.0 m-85 -59.75 -35.42 74.54 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.134 -0.979 . . . . 0.0 109.975 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.3 m -93.54 1.08 56.85 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.186 -0.946 . . . . 0.0 112.075 179.971 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.1 38.34 23.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.453 -1.404 . . . . 0.0 110.749 -179.843 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -141.17 168.42 19.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.203 -0.936 . . . . 0.0 110.147 179.908 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 33.0 t80 -122.84 133.0 54.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.302 -0.874 . . . . 0.0 110.307 -179.739 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 13' ' ' LEU . 6.1 mp -89.23 163.85 15.22 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.11 -0.994 . . . . 0.0 109.721 179.591 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -99.56 -30.81 11.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.081 -1.012 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 44.1 m-70 -114.85 136.1 53.46 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.79 -1.194 . . . . 0.0 110.231 -179.858 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -112.92 92.85 4.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.219 -0.926 . . . . 0.0 109.826 179.75 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.85 178.77 1.51 Allowed Pre-proline 0 N--CA 1.494 1.732 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.715 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.62 -29.58 19.54 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 O-C-N 123.377 1.199 . . . . 0.0 111.137 -179.91 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -88.91 -43.56 11.09 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.948 -1.095 . . . . 0.0 109.936 179.538 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -59.83 -52.65 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.762 179.756 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.433 ' HG2' ' CG ' ' A' ' 4' ' ' PHE . 31.2 mtp-105 -58.03 -49.9 75.27 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.122 -0.986 . . . . 0.0 109.546 179.784 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -61.54 -40.35 94.35 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.841 178.689 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.1 m -54.25 -42.71 70.21 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.105 -0.997 . . . . 0.0 108.639 178.407 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -63.14 -38.65 92.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.606 -0.838 . . . . 0.0 109.075 178.198 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -95.2 53.4 1.52 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.221 -0.924 . . . . 0.0 110.457 -179.702 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.79 40.28 2.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.168 -0.957 . . . . 0.0 109.782 179.618 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.21 147.41 19.19 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 -179.74 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -79.93 -10.36 59.77 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.224 -1.163 . . . . 0.0 111.047 178.864 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -90.54 -19.36 23.86 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.632 -1.293 . . . . 0.0 111.467 179.657 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.6 t-80 -48.63 -40.32 27.26 Favored 'General case' 0 N--CA 1.517 2.925 0 O-C-N 120.681 -1.262 . . . . 0.0 110.907 -179.758 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.15 -52.81 57.25 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.743 179.118 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.29 -38.93 88.56 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.235 -0.915 . . . . 0.0 108.987 178.452 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -55.43 -37.79 68.14 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 8' ' ' TYR . 60.9 t -57.87 -37.49 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.139 -0.976 . . . . 0.0 109.788 179.576 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 27.3 tttt -54.42 -41.11 68.96 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.874 -1.141 . . . . 0.0 109.763 179.38 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.5 -27.95 64.94 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.366 178.961 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -71.35 -53.02 15.56 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.897 -1.127 . . . . 0.0 110.089 179.983 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.85 33.68 2.49 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.151 -0.968 . . . . 0.0 111.256 179.624 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -81.67 -37.25 27.73 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.767 -1.208 . . . . 0.0 110.145 179.027 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -100.06 20.92 13.58 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.195 -0.941 . . . . 0.0 111.212 179.332 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.623 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 15.0 t90 -102.6 -48.62 4.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.837 -1.165 . . . . 0.0 109.951 179.77 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.623 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -124.98 -58.13 1.48 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.24 -0.912 . . . . 0.0 109.997 179.725 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 54.0 38.73 29.51 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.922 -1.111 . . . . 0.0 110.822 179.998 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -145.87 -61.38 0.33 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.169 -0.957 . . . . 0.0 110.156 179.863 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -151.24 74.91 1.16 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.158 -0.964 . . . . 0.0 110.459 179.845 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.25 71.36 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.193 -0.942 . . . . 0.0 110.469 -179.824 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -123.32 32.33 5.69 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.223 -0.923 . . . . 0.0 110.689 179.364 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.02 -48.25 3.94 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.082 -1.011 . . . . 0.0 109.687 179.271 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -21.23 62.33 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.197 -0.94 . . . . 0.0 111.492 179.342 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.716 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -80.85 -40.2 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.666 -1.272 . . . . 0.0 110.001 179.861 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -80.43 -40.98 25.32 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.194 -0.941 . . . . 0.0 109.897 179.791 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -33.27 69.34 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.21 -0.931 . . . . 0.0 110.558 179.751 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.504 2.245 0 O-C-N 120.944 -1.097 . . . . 0.0 110.489 -179.982 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 15.8 mmtt . . . . . 0 N--CA 1.495 1.806 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.488 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.0 t80 -114.57 161.89 17.46 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.992 179.689 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -142.78 131.34 22.45 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.251 -0.906 . . . . 0.0 110.223 -179.457 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.7 t -108.08 92.25 3.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.132 -0.98 . . . . 0.0 110.012 179.339 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -51.44 -35.54 39.95 Favored 'General case' 0 N--CA 1.515 2.824 0 O-C-N 121.151 -0.968 . . . . 0.0 110.539 -179.989 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.888 ' CD2' HG13 ' A' ' 34' ' ' VAL . 79.6 m-85 -61.62 -31.04 71.1 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.059 -1.025 . . . . 0.0 110.144 179.068 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.4 m -100.8 -4.21 28.43 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.936 -1.102 . . . . 0.0 112.334 -179.856 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 t70 54.21 38.68 29.73 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.347 -1.471 . . . . 0.0 110.453 -179.614 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -137.03 169.78 17.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.218 -0.926 . . . . 0.0 109.745 179.785 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 13.9 t80 -119.34 139.54 51.8 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.207 -0.933 . . . . 0.0 110.641 -179.549 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.488 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -104.01 155.83 18.35 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.287 -0.883 . . . . 0.0 109.471 179.396 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.49 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -103.56 -29.43 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.076 -1.015 . . . . 0.0 112.293 -179.122 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.506 ' CB ' HG21 ' A' ' 20' ' ' VAL . 57.6 m-70 -109.62 86.53 2.31 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.778 -1.201 . . . . 0.0 110.481 -179.734 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -73.78 71.08 1.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.24 -0.913 . . . . 0.0 110.169 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -114.45 179.77 0.73 Allowed Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 109.934 179.965 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.7 -31.35 13.32 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.292 1.154 . . . . 0.0 111.067 -179.915 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.5 m -85.53 -46.49 10.79 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.943 -1.098 . . . . 0.0 109.832 179.58 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' A' ' 15' ' ' HIS . 84.6 t -59.06 -52.26 62.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.089 -1.007 . . . . 0.0 109.719 179.802 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 3.1 mtt180 -56.7 -51.44 68.8 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.097 -1.002 . . . . 0.0 109.696 179.842 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -61.6 -40.49 95.0 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.766 178.816 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -55.16 -43.43 74.27 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.056 -1.027 . . . . 0.0 108.408 178.273 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.029 178.052 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -97.8 47.53 1.01 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.241 -0.912 . . . . 0.0 110.513 -179.697 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -116.21 40.23 2.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.139 -0.976 . . . . 0.0 109.815 179.493 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.11 150.36 20.16 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -179.705 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -81.14 -10.04 59.71 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.232 -1.157 . . . . 0.0 111.031 178.844 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mttp -90.46 -21.55 21.82 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.7 -1.25 . . . . 0.0 111.408 179.602 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.2 t-80 -48.33 -37.55 16.85 Favored 'General case' 0 N--CA 1.518 2.97 0 O-C-N 120.806 -1.184 . . . . 0.0 110.998 -179.735 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -63.79 -54.44 35.08 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -60.4 -39.47 87.45 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.273 -0.892 . . . . 0.0 108.968 178.748 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -55.68 -37.41 68.29 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.224 -0.923 . . . . 0.0 110.11 179.158 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.888 HG13 ' CD2' ' A' ' 8' ' ' TYR . 53.0 t -55.67 -35.34 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.015 -1.053 . . . . 0.0 110.222 179.74 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 62.8 tttt -53.1 -41.33 64.85 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.876 -1.14 . . . . 0.0 110.025 179.659 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.67 -28.91 66.18 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.296 -0.877 . . . . 0.0 110.382 178.952 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -68.45 -51.75 40.22 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 120.895 -1.128 . . . . 0.0 110.368 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.1 p90 -100.07 35.55 2.04 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.016 -1.053 . . . . 0.0 111.196 179.753 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -39.23 12.94 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.88 -1.138 . . . . 0.0 109.843 178.72 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -111.65 31.01 6.47 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.297 -0.877 . . . . 0.0 110.639 179.378 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.43 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.3 t90 -94.62 -40.26 9.92 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.082 -1.011 . . . . 0.0 110.152 -179.901 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.43 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -148.47 -63.89 0.25 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 179.954 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -146.79 -164.56 2.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.119 -0.988 . . . . 0.0 110.199 -179.908 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -111.39 39.76 2.24 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.137 -0.977 . . . . 0.0 110.143 179.884 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -144.54 74.45 1.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.233 -0.917 . . . . 0.0 110.216 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.44 71.81 1.3 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.194 -0.941 . . . . 0.0 110.355 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -114.7 35.02 4.45 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.22 -0.925 . . . . 0.0 110.493 179.663 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.2 p -108.37 -53.12 2.67 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.084 -1.01 . . . . 0.0 109.419 179.315 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -20.68 63.98 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.154 -0.966 . . . . 0.0 111.35 179.39 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.792 HD12 HG11 ' A' ' 34' ' ' VAL . 49.6 mm -74.82 -44.08 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.557 -1.339 . . . . 0.0 109.685 179.791 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.84 -41.46 95.86 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.193 -0.942 . . . . 0.0 109.826 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -59.8 -36.22 76.31 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.262 179.872 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.505 2.278 0 O-C-N 121.058 -1.026 . . . . 0.0 110.329 179.743 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 N--CA 1.5 2.054 0 CA-C-O 120.852 0.358 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.598 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.4 t80 -130.51 162.28 29.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.048 -1.033 . . . . 0.0 110.013 -179.683 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 33.4 t80 -135.52 132.65 37.55 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.177 -0.952 . . . . 0.0 110.532 -179.583 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.7 t -110.65 90.09 3.23 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.214 -0.929 . . . . 0.0 109.633 179.248 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -50.06 -34.92 23.17 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.131 -0.981 . . . . 0.0 111.197 -179.603 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.927 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.2 m-85 -64.17 -32.24 73.74 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.848 179.526 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 43.7 m -95.98 -6.36 39.08 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.971 -1.081 . . . . 0.0 112.041 179.696 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 t70 55.81 39.68 30.71 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.447 -1.408 . . . . 0.0 110.352 -179.456 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -140.24 169.68 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 109.79 179.82 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -120.55 144.56 48.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.148 -0.97 . . . . 0.0 110.563 -179.685 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.598 HD13 ' HD1' ' A' ' 4' ' ' PHE . 6.4 mp -102.97 166.42 10.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.16 -0.962 . . . . 0.0 109.771 179.543 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.521 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -104.41 -29.96 10.38 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.103 -0.998 . . . . 0.0 112.285 -179.17 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.74 ' O ' HG11 ' A' ' 20' ' ' VAL . 51.2 m-70 -112.68 124.19 52.0 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.7 -1.25 . . . . 0.0 110.451 -179.577 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -98.69 64.95 1.53 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.107 -0.996 . . . . 0.0 110.408 179.907 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.78 178.36 0.98 Allowed Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.214 -0.929 . . . . 0.0 109.96 179.825 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.07 -35.94 6.44 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.359 1.189 . . . . 0.0 110.736 -179.939 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.3 t -76.23 -39.54 54.27 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.063 -1.023 . . . . 0.0 110.011 179.711 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.74 HG11 ' O ' ' A' ' 15' ' ' HIS . 98.6 t -58.94 -54.53 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.112 -0.993 . . . . 0.0 109.856 179.923 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -55.37 -50.85 68.63 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.054 -1.029 . . . . 0.0 109.793 179.946 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -62.0 -40.85 97.06 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.797 178.77 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.3 m -56.43 -44.17 80.16 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.082 -1.011 . . . . 0.0 108.318 178.324 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -63.21 -38.29 90.6 Favored 'General case' 0 N--CA 1.503 2.192 0 C-N-CA 119.66 -0.816 . . . . 0.0 108.869 178.11 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.9 t -94.34 55.1 1.95 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.307 -0.871 . . . . 0.0 110.206 -179.988 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -114.85 39.84 2.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 110.005 179.759 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -138.52 152.14 21.89 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -81.22 -11.96 59.27 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.238 -1.154 . . . . 0.0 111.183 179.053 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -90.99 -20.92 21.59 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.694 -1.254 . . . . 0.0 111.456 179.704 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.7 t-80 -49.0 -42.39 37.73 Favored 'General case' 0 N--CA 1.518 2.929 0 O-C-N 120.715 -1.24 . . . . 0.0 111.007 -179.627 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 mtmt -62.52 -55.05 31.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.129 -0.982 . . . . 0.0 109.019 179.356 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -38.48 83.03 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.15 178.612 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.08 -39.65 75.39 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.274 -0.891 . . . . 0.0 109.935 179.359 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.927 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.9 t -62.71 -36.2 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.174 -0.954 . . . . 0.0 109.823 179.476 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.2 ttpp -52.33 -39.86 61.2 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 120.998 -1.064 . . . . 0.0 110.079 179.444 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.64 -32.13 68.77 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.195 178.985 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -66.65 -52.42 45.12 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.86 -1.15 . . . . 0.0 110.144 179.933 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.1 33.59 2.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.087 -1.008 . . . . 0.0 111.297 179.592 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -36.41 39.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.783 -1.198 . . . . 0.0 110.163 179.006 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -111.13 30.05 7.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.16 -0.963 . . . . 0.0 110.969 179.701 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 26.2 t90 -92.53 -39.79 11.17 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.119 -0.988 . . . . 0.0 110.124 179.888 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.6 tpp -143.65 -59.95 0.4 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.115 -0.991 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -151.99 -170.32 3.61 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.211 -0.93 . . . . 0.0 110.392 -179.803 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -106.29 52.77 0.72 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.1 -1.0 . . . . 0.0 110.157 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -166.36 73.47 0.16 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.187 -0.945 . . . . 0.0 110.775 179.962 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -146.14 72.07 1.28 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.266 -0.897 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -110.93 36.08 3.28 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.238 -0.914 . . . . 0.0 110.32 179.573 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -110.4 -54.07 2.62 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.151 -0.968 . . . . 0.0 109.617 179.436 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.87 -21.41 63.25 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.244 -0.91 . . . . 0.0 111.458 179.508 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 46.7 mm -70.5 -40.86 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.569 -1.332 . . . . 0.0 109.672 179.651 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -34.83 79.31 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.147 -0.971 . . . . 0.0 110.474 179.838 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -90.08 -39.36 12.94 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.034 -1.041 . . . . 0.0 110.403 179.895 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.3 m . . . . . 0 N--CA 1.508 2.449 0 O-C-N 121.13 -0.981 . . . . 0.0 110.005 179.897 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.447 ' HB2' ' CZ ' ' A' ' 12' ' ' TYR . 46.9 mttt . . . . . 0 N--CA 1.493 1.686 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 . . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.656 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.0 t80 -112.4 161.9 16.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.9 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -131.28 138.28 49.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.165 -0.96 . . . . 0.0 110.401 -179.719 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.5 t -116.83 96.95 5.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.156 -0.965 . . . . 0.0 109.955 179.46 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -51.53 -35.63 41.47 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.014 -1.054 . . . . 0.0 110.658 -179.991 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.669 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.8 m-85 -63.14 -31.07 72.12 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.132 -0.98 . . . . 0.0 110.202 179.252 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 51.7 m -100.07 -10.14 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.972 -1.08 . . . . 0.0 112.055 -179.939 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t0 56.39 40.76 29.6 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.405 -1.434 . . . . 0.0 110.167 -179.464 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -141.76 172.49 12.61 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.221 -0.924 . . . . 0.0 109.985 179.944 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.447 ' CZ ' ' HB2' ' A' ' 3' ' ' LYS . 5.0 t80 -119.96 135.1 55.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.17 -0.956 . . . . 0.0 110.575 -179.72 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.656 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.7 mp -91.48 170.28 10.08 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.234 -0.916 . . . . 0.0 109.687 179.537 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -97.58 -31.68 12.19 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.175 -0.953 . . . . 0.0 111.388 -179.717 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 39.3 m-70 -116.05 135.86 53.56 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.849 -1.157 . . . . 0.0 110.125 179.989 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.01 95.85 5.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.149 -0.969 . . . . 0.0 109.882 179.822 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.73 177.74 1.68 Allowed Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.905 . . . . 0.0 110.247 -179.603 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.5 -32.15 16.01 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.398 1.209 . . . . 0.0 110.969 179.824 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 26.8 m -85.11 -40.26 16.97 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.933 -1.105 . . . . 0.0 109.979 179.562 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -63.18 -49.52 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.135 -0.978 . . . . 0.0 109.688 179.793 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.6 mtm-85 -55.93 -52.14 65.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.061 -1.024 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -61.15 -40.28 93.26 Favored 'General case' 0 N--CA 1.509 2.48 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.883 178.811 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.9 m -55.49 -43.44 75.61 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.085 -1.009 . . . . 0.0 108.368 178.345 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -62.17 -38.8 90.42 Favored 'General case' 0 N--CA 1.504 2.227 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 177.974 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.5 t -95.83 52.34 1.32 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.218 -0.926 . . . . 0.0 110.373 -179.89 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -120.0 37.36 4.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.094 -1.003 . . . . 0.0 110.256 179.775 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.07 128.53 3.45 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.948 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -54.03 -28.89 41.2 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.168 -1.195 . . . . 0.0 110.423 179.199 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -59.75 -35.39 74.49 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.958 -1.089 . . . . 0.0 110.352 179.906 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.3 t-80 -51.25 -38.98 55.66 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.925 -1.11 . . . . 0.0 110.61 -179.611 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -62.18 -55.42 28.8 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.164 -0.96 . . . . 0.0 109.131 179.381 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -59.36 -39.45 83.32 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.249 -0.907 . . . . 0.0 109.124 178.766 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -56.44 -38.39 71.55 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.317 -0.864 . . . . 0.0 109.97 179.252 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.791 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -58.92 -37.11 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.15 -0.969 . . . . 0.0 109.952 179.743 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 31.2 mtmt -53.37 -41.46 65.87 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.969 -1.082 . . . . 0.0 109.863 179.768 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -58.38 -32.37 68.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.311 -0.868 . . . . 0.0 110.152 178.891 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -63.48 -51.31 66.13 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.027 -1.046 . . . . 0.0 110.151 179.935 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.585 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.7 p90 -100.66 36.27 1.96 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.09 -1.006 . . . . 0.0 111.151 179.62 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.15 -37.79 14.78 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.882 -1.137 . . . . 0.0 110.131 178.887 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.96 27.96 9.07 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.194 -0.941 . . . . 0.0 111.014 179.568 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.0 t90 -92.81 -40.49 10.62 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.989 -1.069 . . . . 0.0 110.198 179.921 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.435 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -149.18 -63.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.097 -1.002 . . . . 0.0 110.502 179.954 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.54 2.18 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.207 -0.933 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -109.8 39.42 2.13 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -0.98 . . . . 0.0 110.259 179.787 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -148.45 75.69 1.33 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.157 -0.964 . . . . 0.0 110.299 179.885 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.9 74.67 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.294 -0.879 . . . . 0.0 110.251 -179.836 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.91 35.01 3.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.173 -0.955 . . . . 0.0 110.46 179.611 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.3 p -109.16 -54.75 2.5 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.084 -1.01 . . . . 0.0 109.189 179.152 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -20.51 65.0 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.283 -0.885 . . . . 0.0 111.175 179.154 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.791 HD12 HG11 ' A' ' 34' ' ' VAL . 49.7 mm -75.24 -40.22 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.67 -1.269 . . . . 0.0 109.837 179.778 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -70.57 -40.42 73.33 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.175 -0.953 . . . . 0.0 109.957 179.942 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -58.2 -35.66 71.97 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.252 -0.905 . . . . 0.0 110.488 179.967 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.0 m . . . . . 0 N--CA 1.503 2.216 0 O-C-N 121.091 -1.006 . . . . 0.0 110.155 179.848 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.595 ' HD2' HD13 ' A' ' 13' ' ' LEU . 87.1 t80 -113.31 161.77 16.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.065 -1.022 . . . . 0.0 109.998 179.93 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -137.76 133.66 34.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.272 -0.892 . . . . 0.0 110.278 -179.687 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 t -114.45 98.18 6.75 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.201 -0.937 . . . . 0.0 109.718 179.382 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -56.32 -36.96 69.31 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.101 -0.999 . . . . 0.0 110.758 -179.434 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.966 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -61.93 -32.66 73.08 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.953 -1.092 . . . . 0.0 110.169 179.555 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.8 m -93.31 -6.15 48.07 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.95 -1.094 . . . . 0.0 111.897 179.456 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.71 39.48 31.34 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.443 -1.41 . . . . 0.0 110.437 -179.688 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -142.12 168.08 20.59 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.253 -0.905 . . . . 0.0 109.895 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -118.23 139.99 50.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.571 -179.706 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.595 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.9 mp -97.62 166.3 11.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.24 -0.912 . . . . 0.0 109.657 179.565 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.511 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.91 -30.63 11.55 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.128 -0.983 . . . . 0.0 111.881 -179.452 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.511 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.9 m-70 -118.11 134.98 54.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.799 -1.188 . . . . 0.0 110.226 -179.871 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -112.3 96.73 6.18 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.198 -0.939 . . . . 0.0 109.818 179.685 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -142.52 177.9 1.69 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 -179.568 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -69.87 -29.95 22.54 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.416 1.219 . . . . 0.0 111.039 179.827 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 t -88.72 -44.04 10.85 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.927 -1.108 . . . . 0.0 109.867 179.396 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.405 HG11 ' O ' ' A' ' 15' ' ' HIS . 89.7 t -61.2 -48.96 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.562 0 O-C-N 121.196 -0.94 . . . . 0.0 109.468 179.574 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -59.15 -50.65 73.22 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 109.25 179.541 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -61.7 -40.37 94.79 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.2 -0.937 . . . . 0.0 108.788 178.7 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 88.2 m -54.66 -43.57 72.52 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.042 -1.036 . . . . 0.0 108.455 178.292 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -63.38 -40.36 97.04 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.949 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -94.36 55.7 2.03 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.29 -0.881 . . . . 0.0 110.097 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.95 37.5 3.63 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.18 -0.95 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.08 125.62 2.14 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -179.952 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ttp85 -54.28 -28.34 41.32 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.207 -1.172 . . . . 0.0 110.436 179.157 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -61.22 -31.57 71.35 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.949 -1.094 . . . . 0.0 110.626 179.882 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.8 t-80 -49.35 -38.82 29.54 Favored 'General case' 0 N--CA 1.515 2.782 0 O-C-N 120.903 -1.123 . . . . 0.0 110.937 -179.503 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -63.73 -55.2 25.02 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.101 -1.0 . . . . 0.0 109.039 179.339 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -60.33 -38.99 85.46 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.136 178.682 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -57.16 -36.81 71.22 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.215 -0.928 . . . . 0.0 110.222 179.27 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.966 HG13 ' CD1' ' A' ' 8' ' ' TYR . 97.3 t -58.04 -38.69 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.069 -1.019 . . . . 0.0 109.908 179.898 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 11.3 mttt -58.59 -42.09 87.3 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.009 -1.057 . . . . 0.0 109.454 179.227 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -59.48 -31.15 69.08 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.035 178.805 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 51.2 t80 -67.36 -51.54 50.92 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.012 -1.055 . . . . 0.0 110.346 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.714 ' HE1' HG12 ' A' ' 34' ' ' VAL . 42.4 p90 -99.25 29.84 3.76 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.036 -1.04 . . . . 0.0 111.695 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -78.37 -39.75 38.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.652 -1.28 . . . . 0.0 109.732 178.666 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -115.36 36.87 3.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 179.41 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.9 t90 -92.26 -38.5 12.05 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.175 -0.953 . . . . 0.0 110.19 -179.771 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -147.11 -65.51 0.27 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.16 -0.962 . . . . 0.0 110.347 179.89 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.89 -163.11 1.66 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.205 -0.934 . . . . 0.0 110.152 -179.878 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -103.66 -177.5 3.39 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.104 -0.998 . . . . 0.0 110.073 179.791 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 53.28 74.54 0.3 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.025 -1.047 . . . . 0.0 110.608 -179.743 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.41 70.15 1.42 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.247 -0.908 . . . . 0.0 110.166 -179.967 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.64 33.61 5.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.254 -0.904 . . . . 0.0 110.629 179.595 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.96 -53.04 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.022 -1.049 . . . . 0.0 109.009 179.032 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.8 -20.54 65.12 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.331 -0.855 . . . . 0.0 111.181 178.943 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.722 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -81.53 -55.52 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 120.724 -1.235 . . . . 0.0 109.803 179.714 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -54.64 -38.97 67.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.552 -179.833 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.93 -36.69 82.12 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 179.975 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.503 2.218 0 O-C-N 121.026 -1.046 . . . . 0.0 110.379 179.916 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.98 171.29 17.81 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.438 1.231 . . . . 0.0 110.448 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.409 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 22.4 mttt 61.27 140.53 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.3 -0.875 . . . . 0.0 110.926 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.57 ' HD2' HD13 ' A' ' 13' ' ' LEU . 62.4 t80 -112.71 157.71 20.95 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.99 -1.069 . . . . 0.0 109.979 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -136.36 140.22 43.11 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.187 -0.946 . . . . 0.0 110.471 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.7 t -110.45 97.41 6.86 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.134 -0.979 . . . . 0.0 110.136 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -52.36 -35.87 52.32 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.036 -1.04 . . . . 0.0 110.534 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.83 ' CD1' HG13 ' A' ' 34' ' ' VAL . 93.2 m-85 -62.67 -33.06 74.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.135 -0.978 . . . . 0.0 110.243 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.3 m -100.11 -3.05 32.65 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.028 -1.045 . . . . 0.0 112.282 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 53.24 38.3 27.3 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.409 -1.432 . . . . 0.0 110.75 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 t -129.32 173.53 10.44 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.158 -0.964 . . . . 0.0 110.03 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.409 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -123.69 108.68 12.82 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 110.099 179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.57 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.7 mp -69.57 157.08 37.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.147 -0.971 . . . . 0.0 109.905 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.489 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -101.95 -31.15 10.82 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.21 -0.931 . . . . 0.0 111.875 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.534 ' O ' HG11 ' A' ' 20' ' ' VAL . 48.2 m-70 -112.03 98.47 7.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.744 -1.223 . . . . 0.0 110.33 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.36 71.06 9.42 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.232 -0.918 . . . . 0.0 110.429 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -110.33 179.87 0.76 Allowed Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.085 -1.009 . . . . 0.0 109.908 179.777 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 45.3 Cg_endo -72.81 -30.13 11.76 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.303 1.159 . . . . 0.0 111.421 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -89.84 -40.88 12.15 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 120.929 -1.107 . . . . 0.0 110.088 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.534 HG11 ' O ' ' A' ' 15' ' ' HIS . 77.8 t -58.67 -50.52 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.123 -0.986 . . . . 0.0 109.759 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 mtp-105 -57.56 -51.58 68.88 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.098 -1.001 . . . . 0.0 109.628 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -62.1 -41.09 97.86 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.828 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -54.83 -42.97 72.56 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.137 -0.977 . . . . 0.0 108.552 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.37 -36.12 81.27 Favored 'General case' 0 N--CA 1.503 2.215 0 C-N-CA 119.566 -0.854 . . . . 0.0 109.161 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -99.4 44.81 1.01 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.121 -0.987 . . . . 0.0 110.573 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -116.55 38.19 3.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.106 -0.996 . . . . 0.0 110.137 179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.1 127.28 3.06 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.801 -1.32 . . . . 0.0 109.801 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -54.41 -28.29 42.72 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.209 -1.171 . . . . 0.0 110.338 178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -60.66 -32.18 71.38 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 120.994 -1.066 . . . . 0.0 110.825 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.541 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.0 t-80 -49.8 -37.14 28.88 Favored 'General case' 0 N--CA 1.518 2.939 0 O-C-N 120.884 -1.135 . . . . 0.0 110.914 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -61.83 -55.62 27.94 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.11 -0.994 . . . . 0.0 109.23 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -59.63 -38.83 82.43 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.189 -0.944 . . . . 0.0 109.193 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -55.95 -37.27 68.77 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.153 -0.967 . . . . 0.0 110.13 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.83 HG13 ' CD1' ' A' ' 8' ' ' TYR . 75.8 t -56.15 -35.26 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.63 0 O-C-N 121.021 -1.049 . . . . 0.0 110.186 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 35.7 tttt -53.38 -41.51 65.98 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.875 -1.14 . . . . 0.0 109.93 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -58.4 -29.32 65.96 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.394 178.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -70.92 -52.26 21.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 120.876 -1.14 . . . . 0.0 110.321 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.9 p90 -99.61 33.79 2.41 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.013 -1.055 . . . . 0.0 111.406 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -79.86 -38.15 33.4 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.754 -1.216 . . . . 0.0 110.171 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.1 mtpt -116.5 26.36 9.94 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.244 -0.91 . . . . 0.0 111.372 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.63 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 13.0 t90 -56.09 -43.14 77.75 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.873 -1.142 . . . . 0.0 110.218 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.63 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 19.8 ptp -152.75 38.59 0.53 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.156 -0.965 . . . . 0.0 110.74 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 51.31 39.74 24.73 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.02 -1.05 . . . . 0.0 110.965 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -144.43 -165.63 2.18 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.155 -0.966 . . . . 0.0 110.304 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -117.29 123.98 47.88 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.221 -0.924 . . . . 0.0 110.253 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.404 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -129.91 79.04 1.88 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.418 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 4.1 tt0 -109.34 36.33 2.96 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.11 -0.994 . . . . 0.0 110.463 179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 29.4 t -114.65 -54.98 2.53 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.124 -0.985 . . . . 0.0 109.793 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -22.46 60.74 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.181 -0.949 . . . . 0.0 111.479 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.582 HD12 HG11 ' A' ' 34' ' ' VAL . 42.3 mm -65.15 -51.38 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.419 0 O-C-N 120.648 -1.282 . . . . 0.0 109.367 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.8 OUTLIER -56.2 -39.27 72.17 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.104 -0.997 . . . . 0.0 110.406 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.769 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 6.2 tptt -62.98 -36.01 82.09 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.211 -0.93 . . . . 0.0 110.517 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.0 m -90.12 -38.72 13.33 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.069 -1.019 . . . . 0.0 110.16 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.405 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 61.6 p -68.07 -36.19 79.42 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.136 -0.977 . . . . 0.0 110.227 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.03 -43.78 9.72 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.045 -1.034 . . . . 0.0 110.112 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.57 53.7 1.49 Allowed 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.064 -1.023 . . . . 0.0 110.435 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -91.53 -57.86 2.62 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.232 -0.918 . . . . 0.0 110.107 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -150.78 -57.83 0.17 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.136 -0.977 . . . . 0.0 110.519 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -128.58 68.09 1.38 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.166 -0.959 . . . . 0.0 110.178 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -127.02 63.43 0.6 Allowed Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? . . . . . 0 N--CA 1.501 2.11 0 O-C-N 121.073 -1.251 . . . . 0.0 110.69 -179.98 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 tpp . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.99 166.34 30.31 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.417 1.22 . . . . 0.0 110.347 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.402 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 0.4 OUTLIER 60.9 122.24 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.208 -0.933 . . . . 0.0 110.754 179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 52.7 t80 -104.64 156.43 17.98 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.998 -1.064 . . . . 0.0 110.038 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -127.46 137.41 52.68 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.149 -0.969 . . . . 0.0 110.412 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.35 97.98 6.65 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.287 -0.883 . . . . 0.0 110.07 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -54.77 -36.36 64.79 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.056 -1.027 . . . . 0.0 110.284 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.806 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.3 m-85 -60.26 -32.84 71.55 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.029 -1.045 . . . . 0.0 110.111 179.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.419 ' HB3' HG22 ' A' ' 11' ' ' THR . 35.9 m -95.79 -1.41 49.75 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.037 -1.04 . . . . 0.0 112.033 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.8 t0 52.39 39.02 26.71 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.428 -1.42 . . . . 0.0 110.574 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.419 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.4 t -146.4 171.86 14.38 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.203 -0.936 . . . . 0.0 110.098 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.2 OUTLIER -120.44 122.61 41.08 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.317 -0.864 . . . . 0.0 110.15 -179.786 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.444 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -71.34 170.72 12.55 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.174 -0.954 . . . . 0.0 109.826 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.453 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.3 t -100.22 -29.89 12.21 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.296 -0.877 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.656 ' HB2' HG11 ' A' ' 20' ' ' VAL . 39.4 m-70 -113.25 147.66 37.1 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.696 -1.252 . . . . 0.0 110.404 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -123.62 94.58 4.28 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.28 -0.888 . . . . 0.0 109.9 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.12 177.67 1.72 Allowed Pre-proline 0 N--CA 1.496 1.83 0 O-C-N 121.258 -0.901 . . . . 0.0 110.212 -179.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.4 Cg_endo -70.97 -31.94 14.34 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 O-C-N 123.435 1.229 . . . . 0.0 110.933 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -89.28 -39.62 13.36 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.014 -1.054 . . . . 0.0 110.073 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.656 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.43 -46.54 92.63 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.067 -1.021 . . . . 0.0 109.692 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 15.3 mtp180 -60.55 -49.46 77.47 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.084 -1.01 . . . . 0.0 109.574 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttt -62.28 -41.15 98.24 Favored 'General case' 0 N--CA 1.508 2.466 0 C-N-CA 119.283 -0.967 . . . . 0.0 108.891 179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.2 m -54.58 -42.28 70.87 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.087 -1.008 . . . . 0.0 108.442 178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.5 t60 -63.35 -35.26 79.79 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 119.649 -0.821 . . . . 0.0 109.394 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -100.18 43.54 1.05 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.123 -0.985 . . . . 0.0 110.56 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -114.93 40.39 2.64 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.09 -1.006 . . . . 0.0 109.824 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -131.38 157.04 22.13 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 -179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 ttm-85 -85.51 -10.13 56.45 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.254 -1.145 . . . . 0.0 111.026 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.7 mmmt -90.53 -26.01 19.95 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.691 -1.255 . . . . 0.0 111.11 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.0 t-80 -49.76 -38.88 35.74 Favored 'General case' 0 N--CA 1.517 2.916 0 O-C-N 120.814 -1.179 . . . . 0.0 110.574 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 mtmt -64.58 -53.72 43.38 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.816 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.09 -39.97 91.94 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.196 -0.94 . . . . 0.0 108.999 178.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -56.53 -37.88 71.08 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.205 -0.935 . . . . 0.0 110.031 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.815 HG11 HD12 ' A' ' 50' ' ' ILE . 93.5 t -57.66 -33.73 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.125 -0.984 . . . . 0.0 110.18 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.0 tttt -52.24 -42.26 63.45 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.87 -1.144 . . . . 0.0 109.849 179.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -57.08 -29.53 63.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.336 -0.852 . . . . 0.0 110.375 178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -69.38 -52.02 31.08 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.942 -1.099 . . . . 0.0 110.319 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 44.7 p90 -99.72 35.0 2.1 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.077 -1.014 . . . . 0.0 111.382 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -88.11 -38.34 15.47 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.807 -1.183 . . . . 0.0 109.884 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mttt -112.91 31.58 6.3 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.247 -0.908 . . . . 0.0 110.765 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.445 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -92.85 -41.7 9.93 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.142 -0.974 . . . . 0.0 110.026 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.445 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -154.95 -65.76 0.13 Allowed 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.14 -0.975 . . . . 0.0 110.599 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -126.57 -171.55 2.43 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.155 -0.965 . . . . 0.0 110.005 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.25 38.81 3.44 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.1 -1.0 . . . . 0.0 110.342 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -152.96 75.23 1.08 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.237 -0.914 . . . . 0.0 110.484 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.55 75.43 1.54 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.199 -0.938 . . . . 0.0 110.224 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -111.36 35.86 3.44 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.095 -1.003 . . . . 0.0 110.435 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.54 -55.47 2.5 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.201 -0.937 . . . . 0.0 109.24 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.98 64.51 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.307 -0.871 . . . . 0.0 111.189 179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.815 HD12 HG11 ' A' ' 34' ' ' VAL . 47.8 mm -71.6 -40.27 70.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.62 -1.3 . . . . 0.0 109.618 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.443 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 10.5 t0 -72.76 -39.83 66.5 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.128 -0.983 . . . . 0.0 110.013 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.765 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 11.6 mmtt -57.02 -36.22 70.18 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.179 -0.951 . . . . 0.0 110.63 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 90.0 m -90.53 -46.69 8.16 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.047 -1.033 . . . . 0.0 110.047 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.546 HG23 ' O ' ' A' ' 50' ' ' ILE . 60.0 p -59.71 -35.48 74.6 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.207 -0.933 . . . . 0.0 110.329 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.61 -39.56 12.43 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.073 -1.017 . . . . 0.0 110.391 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.765 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.22 47.23 1.03 Allowed 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.111 -0.993 . . . . 0.0 110.736 179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -92.61 -40.25 10.87 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.112 -0.993 . . . . 0.0 110.107 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -115.25 41.03 2.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.14 -0.975 . . . . 0.0 110.165 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -129.73 71.52 1.45 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.225 -0.922 . . . . 0.0 110.135 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -92.29 -78.23 1.38 Allowed Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.616 -1.394 . . . . 0.0 109.616 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.493 1.701 0 O-C-N 121.226 -1.161 . . . . 0.0 110.251 -179.998 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 ttt . . . . . 0 N--CA 1.492 1.649 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.09 155.06 57.36 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.391 1.206 . . . . 0.0 110.555 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 13.7 mttp -136.43 149.8 48.43 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.194 -0.941 . . . . 0.0 110.06 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CE1' ' NH2' ' A' ' 21' ' ' ARG . 43.5 t80 -114.36 156.36 24.58 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.244 -0.91 . . . . 0.0 110.01 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -135.43 136.79 41.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.14 -0.975 . . . . 0.0 110.399 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -112.27 95.39 5.43 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.209 -0.932 . . . . 0.0 110.222 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -52.94 -36.16 59.55 Favored 'General case' 0 N--CA 1.513 2.723 0 O-C-N 121.026 -1.046 . . . . 0.0 110.383 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.69 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.1 m-85 -60.45 -32.18 71.14 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.149 -0.97 . . . . 0.0 110.067 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.4 m -97.66 -1.54 43.41 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.064 -1.023 . . . . 0.0 112.15 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.92 38.51 27.16 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.377 -1.452 . . . . 0.0 110.567 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -139.5 173.07 11.92 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.162 -0.961 . . . . 0.0 109.964 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.96 119.53 30.69 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.279 -0.888 . . . . 0.0 110.254 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.4 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.2 mp -78.1 163.98 25.39 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.11 -0.994 . . . . 0.0 109.383 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.508 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -101.05 -21.79 14.91 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.132 -0.98 . . . . 0.0 112.166 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.563 ' HB2' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -120.53 139.6 52.67 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 120.628 -1.295 . . . . 0.0 110.145 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -120.6 93.19 3.96 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.253 -0.904 . . . . 0.0 109.78 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.404 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -139.51 178.39 1.65 Allowed Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.321 -0.862 . . . . 0.0 109.993 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.1 Cg_endo -70.62 -26.82 23.09 Favored 'Trans proline' 0 C--N 1.315 -1.196 0 O-C-N 123.351 1.185 . . . . 0.0 111.308 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.08 -40.71 9.92 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.893 -1.129 . . . . 0.0 110.16 179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.563 HG11 ' HB2' ' A' ' 15' ' ' HIS . 83.9 t -60.12 -48.39 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.592 0 O-C-N 121.031 -1.043 . . . . 0.0 109.884 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.421 ' NH2' ' CE1' ' A' ' 4' ' ' PHE . 19.6 mtp180 -56.99 -51.69 68.22 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.132 -0.98 . . . . 0.0 109.86 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -60.18 -40.55 90.38 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.179 -0.95 . . . . 0.0 109.048 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 42.1 m -54.69 -42.92 72.03 Favored 'General case' 0 N--CA 1.513 2.675 0 O-C-N 121.035 -1.041 . . . . 0.0 108.369 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.6 t60 -63.73 -38.61 91.76 Favored 'General case' 0 N--CA 1.502 2.175 0 C-N-CA 119.618 -0.833 . . . . 0.0 109.004 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.02 51.93 1.27 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.298 -0.876 . . . . 0.0 110.488 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.47 37.69 3.82 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.06 -1.025 . . . . 0.0 110.327 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.68 122.8 1.75 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -50.87 -30.26 14.09 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.118 -1.225 . . . . 0.0 110.847 179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -33.16 69.6 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.095 -1.003 . . . . 0.0 110.503 179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.06 -38.28 37.37 Favored 'General case' 0 N--CA 1.517 2.887 0 O-C-N 121.016 -1.053 . . . . 0.0 110.694 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -62.55 -53.17 58.71 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.161 -0.962 . . . . 0.0 108.972 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -60.61 -39.66 89.01 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.221 -0.924 . . . . 0.0 109.0 178.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.13 -38.43 68.21 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.207 -0.933 . . . . 0.0 110.099 179.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.794 HG11 HD12 ' A' ' 50' ' ' ILE . 74.6 t -59.27 -37.9 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.078 -1.014 . . . . 0.0 109.894 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 1.5 tppp? -56.99 -41.79 79.06 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 120.973 -1.08 . . . . 0.0 109.509 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -59.27 -29.81 67.84 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.251 -0.905 . . . . 0.0 110.101 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -68.54 -52.53 30.97 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.957 -1.089 . . . . 0.0 110.28 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.667 ' HE1' HG12 ' A' ' 34' ' ' VAL . 38.1 p90 -98.53 24.82 6.97 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.085 -1.01 . . . . 0.0 111.82 179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.0 tp60 -65.34 -41.23 94.11 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 120.626 -1.296 . . . . 0.0 109.745 179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 mtmt -122.63 26.3 8.35 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.35 -0.844 . . . . 0.0 111.164 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.449 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.0 t90 -64.4 -40.6 96.11 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 120.888 -1.133 . . . . 0.0 110.219 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.449 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.0 mtm -156.29 -56.53 0.09 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.138 -0.976 . . . . 0.0 110.845 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -126.08 -171.84 2.48 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.138 -0.976 . . . . 0.0 110.532 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.06 -34.19 11.25 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.158 -0.964 . . . . 0.0 111.015 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -93.32 96.17 9.79 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.927 -1.108 . . . . 0.0 110.189 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -141.48 71.21 1.35 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.287 -0.883 . . . . 0.0 110.004 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -121.18 34.14 5.31 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.21 -0.931 . . . . 0.0 110.635 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -106.76 -51.48 2.93 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.125 -0.984 . . . . 0.0 109.558 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -21.14 62.73 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.215 -0.928 . . . . 0.0 111.499 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.794 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.85 -56.3 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 O-C-N 120.665 -1.272 . . . . 0.0 109.77 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.34 -36.71 71.51 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.2 tppt? -73.01 -34.04 66.13 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.049 -1.032 . . . . 0.0 110.647 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.6 m -87.7 -39.69 14.76 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.939 -1.101 . . . . 0.0 110.163 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.3 p -55.94 -36.14 67.44 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.514 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.1 -38.35 31.83 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.131 -0.981 . . . . 0.0 110.089 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.89 59.39 3.18 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.096 -1.003 . . . . 0.0 109.923 179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -92.03 -41.52 10.48 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.327 -0.858 . . . . 0.0 110.103 179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -139.88 40.1 1.99 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.149 -0.969 . . . . 0.0 110.286 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -145.29 81.44 1.63 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.224 -0.923 . . . . 0.0 110.374 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -136.04 44.5 1.16 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 ptpt . . . . . 0 N--CA 1.496 1.836 0 O-C-N 121.17 -1.194 . . . . 0.0 110.245 179.977 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 ptp . . . . . 0 N--CA 1.499 1.99 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.05 103.15 1.44 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.277 1.146 . . . . 0.0 110.319 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.457 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 35.0 mmtm -127.0 145.14 50.82 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.112 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.689 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.9 t80 -116.26 161.95 18.23 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -132.72 136.15 46.21 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.237 -0.915 . . . . 0.0 110.212 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -115.39 97.24 6.06 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.199 -0.938 . . . . 0.0 109.905 179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -51.39 -35.57 39.47 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.121 -0.987 . . . . 0.0 110.554 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.534 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.3 m-85 -62.7 -30.8 71.68 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.145 -0.972 . . . . 0.0 110.249 179.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.3 m -100.02 -8.98 23.2 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.952 -1.093 . . . . 0.0 112.118 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.95 42.44 31.06 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 120.391 -1.443 . . . . 0.0 110.087 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -145.35 172.43 13.17 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.289 -0.882 . . . . 0.0 110.29 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.457 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 3.5 t80 -118.29 129.49 55.49 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.255 -0.903 . . . . 0.0 110.305 -179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.689 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.5 mp -85.9 170.2 12.58 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.173 -0.955 . . . . 0.0 109.861 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.591 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -97.26 -21.96 16.96 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.198 -0.939 . . . . 0.0 111.696 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.792 ' HB2' HG11 ' A' ' 20' ' ' VAL . 52.7 m-70 -122.16 147.29 46.34 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.619 -1.301 . . . . 0.0 110.097 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -127.08 93.54 3.78 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.208 -0.933 . . . . 0.0 109.81 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.406 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -148.19 179.1 1.25 Allowed Pre-proline 0 N--CA 1.495 1.815 0 O-C-N 121.284 -0.885 . . . . 0.0 110.17 -179.643 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -71.03 -32.09 13.9 Favored 'Trans proline' 0 C--N 1.316 -1.143 0 O-C-N 123.326 1.171 . . . . 0.0 110.811 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.54 -39.72 17.1 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.975 -1.078 . . . . 0.0 109.956 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.792 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.5 t -64.9 -47.12 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.462 0 O-C-N 121.11 -0.993 . . . . 0.0 109.678 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.451 ' NH1' ' CD2' ' A' ' 4' ' ' PHE . 11.7 mtp180 -57.61 -51.96 67.39 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 121.072 -1.017 . . . . 0.0 109.588 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt -60.77 -40.36 92.23 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.184 -0.948 . . . . 0.0 108.82 178.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -55.18 -43.38 74.3 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.141 -0.975 . . . . 0.0 108.546 178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.448 ' ND1' HD21 ' A' ' 13' ' ' LEU . 70.8 t60 -61.69 -37.29 83.56 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.426 -0.796 . . . . 0.0 109.061 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.25 50.06 1.07 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.187 -0.946 . . . . 0.0 110.369 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.71 37.63 3.88 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.051 -1.031 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.68 128.44 3.35 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.2 tpp85 -54.47 -28.52 45.15 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.141 -1.211 . . . . 0.0 110.413 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -59.5 -35.77 74.79 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.977 -1.077 . . . . 0.0 110.355 179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.448 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.78 -46.09 64.03 Favored 'General case' 0 N--CA 1.514 2.725 0 O-C-N 120.931 -1.106 . . . . 0.0 110.489 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.0 -54.57 45.59 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.086 -1.009 . . . . 0.0 109.427 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -60.09 -39.47 86.23 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.186 -0.946 . . . . 0.0 109.073 178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -56.85 -38.67 73.0 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.948 179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.597 HG12 ' HE2' ' A' ' 38' ' ' TYR . 65.9 t -59.06 -38.21 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.554 0 O-C-N 121.139 -0.976 . . . . 0.0 109.777 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 29.3 ttmt -54.97 -40.58 70.16 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.949 -1.095 . . . . 0.0 109.832 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -58.11 -30.16 66.06 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.304 -0.873 . . . . 0.0 110.229 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.2 t80 -68.24 -53.51 24.15 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.931 -1.106 . . . . 0.0 110.177 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.822 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 39.2 p90 -98.14 22.79 9.01 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.137 -0.977 . . . . 0.0 111.702 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.78 -38.4 90.47 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.593 -1.317 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -113.89 33.28 5.3 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.157 -0.964 . . . . 0.0 110.742 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.478 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 24.5 t90 -92.16 -40.51 10.97 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.19 -0.944 . . . . 0.0 110.151 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.478 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 3.0 ttm -151.78 -62.98 0.17 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.17 -0.956 . . . . 0.0 110.664 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -122.24 -172.9 2.55 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.164 -0.96 . . . . 0.0 110.524 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -98.32 -37.35 9.68 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 121.225 -0.922 . . . . 0.0 110.783 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -105.47 92.81 4.35 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.092 -1.005 . . . . 0.0 110.219 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.822 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -128.52 74.85 1.59 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -0.919 . . . . 0.0 110.13 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -112.16 35.54 3.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.099 -1.001 . . . . 0.0 110.492 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.0 t -110.5 -54.64 2.56 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.096 -1.002 . . . . 0.0 109.395 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.12 -20.7 64.34 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.25 -0.906 . . . . 0.0 111.393 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.647 ' O ' HG23 ' A' ' 54' ' ' THR . 47.6 mm -72.33 -44.91 62.51 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.425 0 O-C-N 120.681 -1.262 . . . . 0.0 109.788 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -62.79 -48.59 78.48 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.168 -0.957 . . . . 0.0 109.887 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.681 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 2.1 ttpm? -56.52 -33.48 66.08 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 121.143 -0.973 . . . . 0.0 110.632 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 79.3 m -89.93 -37.04 14.66 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.945 -1.097 . . . . 0.0 110.351 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.647 HG23 ' O ' ' A' ' 50' ' ' ILE . 82.8 p -74.42 -35.02 63.38 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.037 -1.04 . . . . 0.0 110.543 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -87.36 -34.67 18.73 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.042 -1.036 . . . . 0.0 110.633 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.87 36.87 1.47 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.945 -1.097 . . . . 0.0 111.343 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -91.51 -45.07 8.72 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.997 -1.064 . . . . 0.0 110.116 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.51 73.8 1.52 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.117 -0.99 . . . . 0.0 110.137 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -116.5 -58.37 2.09 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.177 -0.952 . . . . 0.0 110.255 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -118.99 -103.55 2.1 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.2 mttp . . . . . 0 N--CA 1.494 1.732 0 O-C-N 121.113 -1.228 . . . . 0.0 110.167 179.956 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.237 -0.282 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.57 148.31 47.45 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 O-C-N 123.361 1.19 . . . . 0.0 110.474 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 40.4 mttt -135.56 156.42 48.91 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.18 -0.95 . . . . 0.0 110.216 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.8 t80 -110.4 161.65 15.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.103 -0.998 . . . . 0.0 110.522 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD2' ' A' ' 4' ' ' PHE . 34.9 t80 -133.7 134.06 42.62 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.252 -0.905 . . . . 0.0 110.115 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.9 t -113.53 96.39 5.85 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.141 -0.975 . . . . 0.0 110.177 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.1 p-10 -53.71 -36.34 62.13 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.388 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.596 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.6 m-85 -60.74 -32.4 71.67 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.091 -1.006 . . . . 0.0 110.156 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.409 ' HB3' HG22 ' A' ' 11' ' ' THR . 33.5 m -96.99 -5.94 36.62 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.076 -1.015 . . . . 0.0 112.116 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 54.75 39.98 31.67 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.349 -1.47 . . . . 0.0 110.23 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.409 HG22 ' HB3' ' A' ' 9' ' ' CYS . 9.1 t -143.42 172.24 13.05 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.236 -0.915 . . . . 0.0 109.918 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -117.34 138.82 51.53 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.271 -0.893 . . . . 0.0 110.469 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.0 mp -97.68 168.42 10.35 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.222 -0.924 . . . . 0.0 109.769 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.515 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -99.38 -29.07 12.98 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.217 -0.927 . . . . 0.0 111.73 -179.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.71 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.6 m-70 -112.06 148.42 33.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.774 -1.204 . . . . 0.0 110.431 -179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -126.92 93.93 3.89 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.331 -0.856 . . . . 0.0 109.761 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -150.82 178.52 1.49 Allowed Pre-proline 0 N--CA 1.497 1.885 0 O-C-N 121.272 -0.893 . . . . 0.0 110.305 -179.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.07 -33.3 11.94 Favored 'Trans proline' 0 C--N 1.317 -1.096 0 O-C-N 123.354 1.186 . . . . 0.0 110.735 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.7 t -83.16 -38.59 22.15 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.011 -1.056 . . . . 0.0 110.033 179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.71 HG11 ' HB2' ' A' ' 15' ' ' HIS . 62.2 t -64.1 -47.38 90.43 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HB3' ' CE1' ' A' ' 57' ' ' PHE . 36.3 mtp180 -57.97 -50.07 74.62 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.097 -1.002 . . . . 0.0 109.53 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -62.12 -40.99 97.77 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.214 -0.929 . . . . 0.0 108.655 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -55.48 -43.84 75.92 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.159 -0.963 . . . . 0.0 108.487 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -62.59 -39.49 93.88 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.353 -0.842 . . . . 0.0 108.863 177.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.5 t -92.42 56.0 2.65 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.278 -0.889 . . . . 0.0 110.335 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -118.5 37.42 4.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.127 -0.983 . . . . 0.0 110.414 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.15 128.27 3.23 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.4 tpt180 -54.54 -28.18 43.7 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.153 -1.204 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.2 mttp -61.26 -34.87 75.87 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.941 -1.1 . . . . 0.0 110.522 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.454 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.1 t-80 -51.47 -40.66 59.92 Favored 'General case' 0 N--CA 1.514 2.772 0 O-C-N 120.951 -1.093 . . . . 0.0 110.523 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.2 tttt -62.75 -55.61 25.03 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.196 -0.94 . . . . 0.0 109.064 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -59.34 -38.85 81.38 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.2 -0.938 . . . . 0.0 109.189 178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.62 -38.23 71.81 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.242 -0.911 . . . . 0.0 110.114 179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.8 HG11 HD12 ' A' ' 50' ' ' ILE . 79.5 t -64.46 -39.57 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.421 0 O-C-N 121.134 -0.978 . . . . 0.0 109.641 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.3 ttpt -58.38 -42.79 87.86 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.069 -1.019 . . . . 0.0 109.348 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.02 -30.2 67.84 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.529 -0.869 . . . . 0.0 110.283 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -70.41 -51.82 26.81 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.901 -1.125 . . . . 0.0 110.322 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.721 ' HE1' HG12 ' A' ' 34' ' ' VAL . 40.3 p90 -100.03 34.54 2.28 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.13 -0.981 . . . . 0.0 111.295 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.3 tp60 -78.3 -39.63 39.2 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.814 -1.179 . . . . 0.0 110.0 179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 tttm -117.82 22.69 12.15 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.243 -0.91 . . . . 0.0 111.53 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.457 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 13.1 t90 -57.61 -55.29 36.75 Favored 'General case' 0 N--CA 1.511 2.589 0 O-C-N 120.796 -1.19 . . . . 0.0 110.151 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.457 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 13.2 mtt -149.1 -63.1 0.23 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -122.79 -171.95 2.39 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.161 -0.962 . . . . 0.0 110.06 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -110.76 39.72 2.17 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.227 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -145.55 75.02 1.41 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.232 -0.917 . . . . 0.0 110.174 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.46 71.73 1.32 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.239 -0.913 . . . . 0.0 110.343 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.76 34.71 5.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.254 -0.904 . . . . 0.0 110.574 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.408 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 7.2 p -108.12 -52.57 2.75 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.056 -1.027 . . . . 0.0 109.418 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.408 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -60.92 -21.12 63.08 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.195 -0.941 . . . . 0.0 111.418 179.376 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.8 HD12 HG11 ' A' ' 34' ' ' VAL . 49.5 mm -76.12 -52.22 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 O-C-N 120.659 -1.276 . . . . 0.0 109.597 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 26.1 t0 -58.45 -39.39 79.72 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.2 -0.937 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -55.88 -36.34 67.49 Favored 'General case' 0 N--CA 1.511 2.585 0 O-C-N 121.076 -1.015 . . . . 0.0 110.625 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 69.1 m -91.69 -45.9 8.2 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.08 -1.013 . . . . 0.0 110.172 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.446 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 77.1 p -62.02 -39.69 93.15 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.188 -0.945 . . . . 0.0 110.042 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.19 -44.81 92.22 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.123 -0.986 . . . . 0.0 110.155 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.96 -37.12 73.59 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.124 -0.985 . . . . 0.0 110.507 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.417 ' CE1' ' HB3' ' A' ' 21' ' ' ARG . 7.0 m-85 -58.86 -38.94 79.89 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.05 -1.031 . . . . 0.0 110.462 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -130.4 -58.44 1.05 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.095 -1.003 . . . . 0.0 110.769 -179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 56.19 44.3 25.25 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.932 -1.105 . . . . 0.0 110.306 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -130.84 43.31 1.31 Allowed Glycine 0 N--CA 1.493 2.45 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.134 0 O-C-N 121.07 -1.253 . . . . 0.0 110.791 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.197 0 CA-C-O 119.845 -0.121 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -79.28 102.96 1.56 Allowed 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.079 1.041 . . . . 0.0 110.347 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 44.5 mttt -137.73 158.11 45.06 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.072 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 78.2 t80 -115.65 162.06 17.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.112 -0.993 . . . . 0.0 110.089 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -136.18 132.83 36.47 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.202 -0.936 . . . . 0.0 110.187 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.1 t -112.44 94.1 4.76 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.085 -1.009 . . . . 0.0 110.051 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -52.06 -35.98 49.13 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.074 -1.016 . . . . 0.0 110.518 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.765 ' CD1' HG13 ' A' ' 34' ' ' VAL . 83.5 m-85 -61.07 -32.8 72.44 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.18 -0.95 . . . . 0.0 110.017 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.5 m -97.47 -4.08 38.76 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.001 -1.062 . . . . 0.0 112.261 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 53.54 38.99 29.42 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.446 -1.409 . . . . 0.0 110.479 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 t -140.68 170.33 15.98 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.904 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -119.11 137.08 53.83 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -95.12 163.98 13.06 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.297 -0.877 . . . . 0.0 109.508 179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.465 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.41 -31.65 11.2 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.041 -1.037 . . . . 0.0 111.724 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.465 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.5 m-70 -114.61 132.96 56.18 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.718 -1.239 . . . . 0.0 110.194 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -112.84 95.94 5.69 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.257 -0.902 . . . . 0.0 109.809 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -141.58 179.37 1.24 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.2 -0.937 . . . . 0.0 109.966 -179.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.17 -28.04 19.25 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.314 1.165 . . . . 0.0 111.176 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.88 -41.94 10.89 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.901 -1.125 . . . . 0.0 109.974 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.436 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.1 t -60.92 -50.96 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.524 0 O-C-N 121.178 -0.951 . . . . 0.0 109.66 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 36.8 mtp180 -57.09 -51.11 70.61 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.125 -0.984 . . . . 0.0 109.607 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 45.0 mttt -61.33 -40.57 94.7 Favored 'General case' 0 N--CA 1.507 2.408 0 C-N-CA 119.308 -0.957 . . . . 0.0 108.797 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 92.5 m -54.77 -43.56 72.87 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.121 -0.987 . . . . 0.0 108.443 178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.4 t60 -63.47 -39.72 95.21 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.752 -0.832 . . . . 0.0 108.752 177.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -96.08 52.12 1.27 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.9 m -117.83 37.63 3.89 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.154 -0.966 . . . . 0.0 110.347 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.67 127.28 2.68 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.944 -1.263 . . . . 0.0 109.944 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.6 ttt-85 -54.37 -28.69 44.87 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.033 -1.275 . . . . 0.0 110.169 178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -58.46 -33.87 70.23 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 120.99 -1.068 . . . . 0.0 110.464 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -50.47 -38.71 45.35 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 120.925 -1.109 . . . . 0.0 110.75 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.6 ttpp -63.16 -54.28 40.08 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.104 -0.998 . . . . 0.0 108.945 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -60.13 -38.98 84.69 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.11 178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -56.11 -38.33 70.61 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 121.24 -0.913 . . . . 0.0 110.117 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.765 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.5 t -59.14 -37.32 67.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.062 -1.024 . . . . 0.0 109.879 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.3 ttpp -53.41 -39.97 64.73 Favored 'General case' 0 N--CA 1.513 2.724 0 O-C-N 120.887 -1.133 . . . . 0.0 109.845 179.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -58.47 -30.79 67.25 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.293 -0.879 . . . . 0.0 110.222 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -68.05 -53.26 27.05 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.984 -1.072 . . . . 0.0 109.967 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' OH ' ' HG3' ' A' ' 47' ' ' GLN . 41.7 p90 -100.08 33.29 2.66 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.097 -1.002 . . . . 0.0 111.248 179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 -73.62 -39.11 64.8 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.771 -1.205 . . . . 0.0 110.112 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -110.16 32.35 5.2 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.211 -0.931 . . . . 0.0 110.553 179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' HE3' ' A' ' 42' ' ' MET . 21.7 t90 -107.27 -57.9 2.02 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.152 -0.968 . . . . 0.0 110.228 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.463 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 2.1 ttm -140.5 63.08 1.48 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.271 -0.893 . . . . 0.0 109.627 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -45.17 -34.15 2.59 Favored 'General case' 0 N--CA 1.516 2.869 0 O-C-N 121.363 -0.836 . . . . 0.0 111.587 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -81.35 129.41 34.61 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.042 -1.036 . . . . 0.0 109.32 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 54.71 71.69 0.51 Allowed 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.976 -1.078 . . . . 0.0 110.213 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -131.25 -174.02 3.27 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.362 -0.836 . . . . 0.0 110.445 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.453 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 56.76 34.03 23.95 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.346 -0.846 . . . . 0.0 110.542 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.96 -56.57 2.31 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.11 -0.993 . . . . 0.0 109.368 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.92 -22.2 62.12 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.223 -0.923 . . . . 0.0 111.213 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.743 HD12 HG11 ' A' ' 34' ' ' VAL . 42.5 mm -64.13 -42.78 96.66 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 120.702 -1.249 . . . . 0.0 108.991 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.73 -37.25 73.25 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.335 -0.853 . . . . 0.0 110.391 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -72.1 -34.55 68.73 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.105 -0.997 . . . . 0.0 110.617 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.4 m -83.73 -40.44 18.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.006 -1.059 . . . . 0.0 110.167 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.9 p -59.8 -37.57 79.51 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.121 -0.987 . . . . 0.0 110.176 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -83.02 -40.18 20.28 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.082 -1.011 . . . . 0.0 109.865 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.09 -34.77 66.32 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.164 -0.96 . . . . 0.0 110.492 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -91.95 11.89 23.56 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.085 -1.01 . . . . 0.0 111.989 179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -114.16 -55.69 2.47 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.565 -1.334 . . . . 0.0 110.203 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -115.01 -56.32 2.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.198 -0.938 . . . . 0.0 110.163 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 125.75 -62.27 0.6 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.8 ttmt . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.214 -1.168 . . . . 0.0 110.184 -179.954 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ttt . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.87 171.11 18.09 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.41 1.216 . . . . 0.0 110.439 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 mttt 55.56 169.94 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.365 -0.834 . . . . 0.0 110.844 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.571 ' HD1' HD13 ' A' ' 13' ' ' LEU . 77.5 t80 -125.57 162.45 24.91 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.128 -0.982 . . . . 0.0 110.137 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -131.91 135.71 46.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.226 -0.921 . . . . 0.0 110.535 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.0 t -112.79 95.55 5.48 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.175 -0.953 . . . . 0.0 109.731 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -50.85 -35.24 31.51 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.16 -0.962 . . . . 0.0 110.725 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.858 ' CD1' HG13 ' A' ' 34' ' ' VAL . 74.3 m-85 -63.54 -30.64 71.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.094 -1.004 . . . . 0.0 110.155 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.6 m -100.01 -8.83 23.38 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.968 -1.082 . . . . 0.0 112.107 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 t0 55.91 40.64 30.5 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 120.368 -1.458 . . . . 0.0 110.121 -179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.04 173.64 11.33 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.313 -0.867 . . . . 0.0 109.957 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -120.64 131.13 54.44 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.685 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.571 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -88.42 172.04 9.67 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.239 -0.913 . . . . 0.0 109.567 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -98.3 -31.93 11.8 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.148 -0.97 . . . . 0.0 111.469 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 28.1 m-70 -121.04 134.65 55.29 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.807 -1.183 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.401 ' OD1' ' CD2' ' A' ' 4' ' ' PHE . 24.0 t0 -113.06 97.27 6.41 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.149 -0.97 . . . . 0.0 109.895 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -144.34 179.4 1.18 Allowed Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.225 -0.922 . . . . 0.0 110.015 -179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.5 Cg_endo -71.19 -31.32 14.69 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.303 1.16 . . . . 0.0 110.853 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.8 t -86.16 -38.97 17.15 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.923 -1.11 . . . . 0.0 110.069 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 15' ' ' HIS . 80.7 t -67.61 -46.35 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 121.119 -0.988 . . . . 0.0 109.751 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.0 mtp180 -56.92 -52.34 65.57 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.054 -1.028 . . . . 0.0 109.757 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -60.67 -40.19 91.21 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.156 -0.965 . . . . 0.0 108.871 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.6 m -55.09 -43.37 73.89 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.101 -0.999 . . . . 0.0 108.515 178.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -62.29 -38.48 89.53 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.396 -0.815 . . . . 0.0 109.004 178.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -94.92 52.81 1.51 Allowed 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.22 -0.925 . . . . 0.0 110.447 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.6 m -117.66 39.47 3.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.089 -1.007 . . . . 0.0 109.899 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -132.78 160.11 23.71 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt-85 -88.32 -10.99 47.64 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.334 -1.098 . . . . 0.0 110.83 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.1 mtpp -91.14 -24.35 19.99 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.582 -1.324 . . . . 0.0 111.212 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.693 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.5 t-80 -48.9 -38.51 22.86 Favored 'General case' 0 N--CA 1.517 2.897 0 O-C-N 120.813 -1.179 . . . . 0.0 110.813 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 tmtt? -64.94 -54.41 31.04 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.24 -0.984 . . . . 0.0 108.906 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.03 -39.26 89.13 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.229 -0.92 . . . . 0.0 109.073 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -56.98 -37.18 71.27 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.13 -0.981 . . . . 0.0 110.021 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.858 HG13 ' CD1' ' A' ' 8' ' ' TYR . 71.8 t -55.85 -37.98 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.556 0 O-C-N 120.975 -1.078 . . . . 0.0 110.079 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.0 tttt -58.98 -42.96 91.21 Favored 'General case' 0 N--CA 1.511 2.583 0 O-C-N 121.057 -1.027 . . . . 0.0 109.293 179.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -59.35 -26.3 64.93 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.467 178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -74.43 -51.92 13.54 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.875 -1.141 . . . . 0.0 110.426 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 34.4 p90 -99.41 31.98 2.93 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.057 -1.027 . . . . 0.0 111.495 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -76.16 -40.25 52.98 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.724 -1.235 . . . . 0.0 110.131 179.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 24.6 mttp -84.65 -32.04 23.86 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.248 -0.908 . . . . 0.0 110.182 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.468 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 5.9 t90 -50.21 -45.31 53.63 Favored 'General case' 0 N--CA 1.513 2.681 0 O-C-N 120.971 -1.081 . . . . 0.0 111.058 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.468 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -114.72 -55.3 2.5 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.225 -0.922 . . . . 0.0 110.341 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 53.65 38.34 28.1 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.978 -1.076 . . . . 0.0 110.739 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -157.55 -56.66 0.08 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.183 -0.948 . . . . 0.0 110.761 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -164.18 82.77 0.42 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.165 -0.959 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.461 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -138.77 72.53 1.41 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -126.29 36.63 4.46 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.259 -0.901 . . . . 0.0 110.277 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.39 -53.85 2.66 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.148 -0.97 . . . . 0.0 109.745 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.37 -21.41 62.1 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.255 -0.903 . . . . 0.0 111.522 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.698 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -71.75 -50.68 37.06 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 O-C-N 120.608 -1.308 . . . . 0.0 109.521 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -64.86 -39.39 93.48 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.274 -0.891 . . . . 0.0 109.915 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -55.74 -33.43 64.26 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.095 -1.003 . . . . 0.0 110.731 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.1 m -90.13 -35.78 15.21 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 120.968 -1.083 . . . . 0.0 110.682 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 69.1 p -79.96 -37.46 34.36 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.014 -1.054 . . . . 0.0 110.294 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.11 -39.87 40.0 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.065 -1.022 . . . . 0.0 109.812 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 52' ' ' LYS . . . -50.49 -31.11 14.43 Favored 'General case' 0 N--CA 1.513 2.71 0 O-C-N 121.087 -1.008 . . . . 0.0 111.18 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 -82.67 -39.0 22.66 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 120.951 -1.093 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -138.02 77.95 1.66 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.065 -1.022 . . . . 0.0 110.577 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -163.61 42.16 0.1 Allowed 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.154 -0.966 . . . . 0.0 110.882 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 137.28 -61.28 0.6 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.3 tttm . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.19 -1.183 . . . . 0.0 110.209 179.995 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mtt . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 92.18 0.8 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.417 1.22 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 61.4 mttt -133.79 146.07 50.35 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.221 -0.924 . . . . 0.0 110.175 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.592 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.2 t80 -108.04 161.45 14.94 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.28 -0.888 . . . . 0.0 110.164 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -135.05 137.45 42.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.283 -0.886 . . . . 0.0 110.002 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.7 t -119.26 96.91 5.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.101 -0.999 . . . . 0.0 110.294 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -53.87 -35.9 62.05 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.053 -1.029 . . . . 0.0 110.293 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.608 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.6 m-85 -60.59 -32.89 71.98 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.122 -0.986 . . . . 0.0 110.117 179.196 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 46.2 m -97.34 -4.37 38.69 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.061 -1.025 . . . . 0.0 112.198 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 53.45 39.4 29.9 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.376 -1.452 . . . . 0.0 110.573 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.76 170.06 16.4 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.294 -0.879 . . . . 0.0 109.992 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.419 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 14.6 t80 -118.41 134.05 55.38 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.322 -0.861 . . . . 0.0 110.423 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.592 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.7 mp -90.09 161.81 15.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.191 -0.943 . . . . 0.0 109.664 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.434 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.69 -21.95 16.16 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.101 -0.999 . . . . 0.0 111.888 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.776 ' HB2' HG11 ' A' ' 20' ' ' VAL . 42.7 m-70 -115.28 143.94 44.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.635 -1.291 . . . . 0.0 110.11 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -125.78 92.29 3.57 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 109.715 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.57 178.57 1.45 Allowed Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.229 -0.919 . . . . 0.0 110.043 -179.736 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -70.82 -28.67 19.84 Favored 'Trans proline' 0 C--N 1.316 -1.141 0 O-C-N 123.438 1.23 . . . . 0.0 111.078 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.61 -41.6 10.67 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.882 -1.136 . . . . 0.0 110.004 179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.776 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.9 t -59.44 -54.05 39.7 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.669 0 O-C-N 121.093 -1.005 . . . . 0.0 109.728 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 20.4 mtp-105 -56.17 -50.52 70.95 Favored 'General case' 0 N--CA 1.512 2.627 0 O-C-N 121.163 -0.961 . . . . 0.0 109.731 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.2 mtpp -61.99 -40.44 95.64 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.334 -0.946 . . . . 0.0 108.818 178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.4 m -54.5 -43.07 71.49 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.117 -0.989 . . . . 0.0 108.368 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.7 t60 -62.45 -37.55 86.33 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.392 -0.818 . . . . 0.0 108.886 177.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -99.26 45.17 1.0 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.261 -0.899 . . . . 0.0 110.448 -179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.2 m -116.6 38.14 3.54 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.215 -0.928 . . . . 0.0 110.182 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.17 128.71 3.79 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 51.9 ttp85 -55.38 -27.49 47.87 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.225 -1.162 . . . . 0.0 110.545 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -62.53 -33.53 75.09 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 120.996 -1.065 . . . . 0.0 110.669 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.622 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.2 t-80 -51.32 -39.0 56.0 Favored 'General case' 0 N--CA 1.516 2.851 0 O-C-N 120.877 -1.139 . . . . 0.0 110.508 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.9 tttt -63.21 -55.1 27.81 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.35 -0.94 . . . . 0.0 109.057 179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -60.01 -39.52 86.1 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.211 -0.93 . . . . 0.0 109.111 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -56.6 -38.27 71.79 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.17 -0.956 . . . . 0.0 110.012 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.675 HG11 HD12 ' A' ' 50' ' ' ILE . 71.5 t -56.73 -35.01 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.121 -0.987 . . . . 0.0 110.123 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 33.6 tttt -53.32 -44.57 68.5 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.812 -1.18 . . . . 0.0 109.932 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -58.42 -28.89 65.67 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.282 -0.887 . . . . 0.0 110.407 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -74.31 -50.75 17.53 Favored 'General case' 0 N--CA 1.507 2.393 0 O-C-N 120.947 -1.096 . . . . 0.0 110.575 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.602 ' CE2' HG12 ' A' ' 34' ' ' VAL . 37.9 p90 -99.31 34.42 2.18 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.029 -1.044 . . . . 0.0 111.451 179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -90.97 -41.21 11.25 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.723 -1.235 . . . . 0.0 109.656 178.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -112.53 32.83 5.33 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.346 -0.846 . . . . 0.0 110.26 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.462 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 16.2 t90 -97.7 -41.87 7.89 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.185 -0.947 . . . . 0.0 110.439 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.462 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -115.69 -67.96 0.96 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.063 -1.023 . . . . 0.0 110.108 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -167.17 -60.66 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.15 -0.969 . . . . 0.0 111.175 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -172.21 -51.52 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.074 -1.016 . . . . 0.0 111.093 -179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -81.12 89.0 5.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.111 -0.993 . . . . 0.0 110.3 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.401 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -145.78 69.42 1.22 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.236 -0.915 . . . . 0.0 110.136 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -122.32 35.38 4.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.222 -0.924 . . . . 0.0 110.552 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 m -108.16 -52.68 2.73 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.194 -0.941 . . . . 0.0 109.499 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -20.94 63.34 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.254 -0.904 . . . . 0.0 111.478 179.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.675 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.77 -56.18 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 120.699 -1.251 . . . . 0.0 109.806 179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.421 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 70.0 m-20 -56.97 -39.43 74.59 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.167 -0.958 . . . . 0.0 110.312 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -57.13 -36.47 70.73 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.117 -0.99 . . . . 0.0 110.48 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.0 m -91.25 -35.92 14.21 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.063 -1.023 . . . . 0.0 110.541 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.421 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 80.6 p -77.37 -39.88 45.77 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.022 -1.049 . . . . 0.0 110.137 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.75 -40.6 92.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.101 -0.999 . . . . 0.0 109.898 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.56 79.94 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.221 -0.925 . . . . 0.0 110.221 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -53.14 -37.17 61.6 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 121.054 -1.029 . . . . 0.0 110.731 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -113.33 66.6 0.66 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.088 -1.008 . . . . 0.0 110.15 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -116.43 -57.03 2.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.115 -0.991 . . . . 0.0 110.249 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 63.61 75.15 0.37 Allowed Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.1 tttp . . . . . 0 N--CA 1.493 1.697 0 O-C-N 121.173 -1.193 . . . . 0.0 110.247 -179.983 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 8.2 mtt . . . . . 0 N--CA 1.491 1.579 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.55 131.39 17.35 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.469 1.247 . . . . 0.0 110.387 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.441 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 16.8 mtmt -141.82 148.56 39.06 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.196 -0.94 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -110.88 152.07 27.14 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.221 -0.924 . . . . 0.0 109.629 179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -128.95 136.0 49.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.2 t -110.15 94.5 5.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 110.168 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -51.73 -35.57 43.72 Favored 'General case' 0 N--CA 1.515 2.777 0 O-C-N 121.051 -1.03 . . . . 0.0 110.459 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.86 ' CD1' HG13 ' A' ' 34' ' ' VAL . 78.3 m-85 -61.85 -32.2 72.51 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.174 -0.953 . . . . 0.0 110.057 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.4 m -98.29 -0.96 42.92 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.993 -1.067 . . . . 0.0 112.146 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 52.25 38.87 25.87 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.407 -1.433 . . . . 0.0 110.69 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -140.21 171.23 14.47 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.231 -0.918 . . . . 0.0 109.978 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.441 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.4 OUTLIER -122.1 119.14 30.49 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.205 -0.935 . . . . 0.0 110.145 -179.758 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.7 mp -75.99 166.71 23.09 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.145 -0.972 . . . . 0.0 109.489 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -100.37 -30.38 11.88 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.153 -0.967 . . . . 0.0 111.725 -179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.652 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.3 m-70 -112.44 142.18 45.29 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.732 -1.23 . . . . 0.0 110.154 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -121.41 89.71 3.18 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.184 -0.948 . . . . 0.0 109.714 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -136.59 178.44 1.74 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.847 . . . . 0.0 110.046 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.53 -29.94 19.46 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.103 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 67.8 m -90.32 -43.63 10.22 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.923 -1.11 . . . . 0.0 109.91 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.652 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.8 t -59.58 -53.77 43.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.632 0 O-C-N 121.184 -0.948 . . . . 0.0 109.789 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.0 mtp-105 -56.76 -50.22 72.91 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.145 -0.972 . . . . 0.0 109.699 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.0 mmtt -61.93 -40.29 94.98 Favored 'General case' 0 N--CA 1.507 2.387 0 C-N-CA 119.316 -0.954 . . . . 0.0 108.802 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.7 m -54.53 -42.66 71.16 Favored 'General case' 0 N--CA 1.51 2.564 0 O-C-N 121.013 -1.054 . . . . 0.0 108.684 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -61.69 -37.63 84.83 Favored 'General case' 0 N--CA 1.503 2.223 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.167 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -95.32 53.12 1.47 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.234 -0.916 . . . . 0.0 110.423 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -118.71 38.22 3.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.1 -1.0 . . . . 0.0 110.101 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -140.25 130.01 4.45 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 14.5 ttm105 -59.29 -23.98 62.88 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.231 -1.158 . . . . 0.0 110.854 179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.4 mttt -71.06 -27.48 63.67 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 120.819 -1.176 . . . . 0.0 111.45 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.611 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.7 t-80 -49.55 -37.89 28.88 Favored 'General case' 0 N--CA 1.517 2.896 0 O-C-N 120.735 -1.228 . . . . 0.0 110.806 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -63.17 -54.2 41.38 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.087 -1.008 . . . . 0.0 109.112 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -60.46 -40.14 90.14 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.144 -0.972 . . . . 0.0 109.057 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 -55.98 -37.22 68.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.223 -0.923 . . . . 0.0 110.046 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.86 HG13 ' CD1' ' A' ' 8' ' ' TYR . 73.8 t -55.92 -33.64 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.589 0 O-C-N 121.129 -0.982 . . . . 0.0 110.291 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.453 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 5.0 tttt -53.2 -41.94 65.79 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.825 -1.172 . . . . 0.0 109.994 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.56 -27.77 64.89 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.499 -0.88 . . . . 0.0 110.437 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.02 -52.26 13.3 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 120.877 -1.139 . . . . 0.0 110.499 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.905 ' CE2' ' HB3' ' A' ' 46' ' ' ALA . 35.5 p90 -99.01 31.63 2.94 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.004 -1.06 . . . . 0.0 111.656 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -75.59 -38.3 59.2 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.661 -1.274 . . . . 0.0 110.027 179.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.7 mttt -113.28 34.24 4.62 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.255 -0.903 . . . . 0.0 110.563 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.3 t90 -98.21 -47.12 5.58 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.147 -0.971 . . . . 0.0 110.028 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.7 ttm -148.14 -63.63 0.25 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.352 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -120.24 -177.29 3.4 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.305 -0.872 . . . . 0.0 110.251 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -97.72 -37.73 9.77 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.19 -0.943 . . . . 0.0 110.68 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -109.72 112.33 24.33 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.049 -1.032 . . . . 0.0 110.27 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.905 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -148.74 76.74 1.36 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.217 -0.927 . . . . 0.0 110.242 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -106.48 35.71 2.87 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.063 -1.023 . . . . 0.0 110.462 179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -111.9 -55.17 2.54 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.069 -1.019 . . . . 0.0 109.276 179.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.262 -0.899 . . . . 0.0 111.316 179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.501 HD12 HG11 ' A' ' 34' ' ' VAL . 47.6 mm -70.37 -44.78 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.7 -1.25 . . . . 0.0 109.514 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -58.13 -40.8 82.2 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.189 -0.944 . . . . 0.0 110.029 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 27.6 mttt -61.19 -34.91 75.84 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.234 -0.916 . . . . 0.0 110.483 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.44 HG22 ' HD2' ' A' ' 57' ' ' PHE . 86.1 m -87.59 -46.24 9.72 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.979 -1.076 . . . . 0.0 110.174 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 42.7 p -58.74 -37.63 76.62 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.072 -1.017 . . . . 0.0 110.251 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.86 -43.74 9.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.141 -0.974 . . . . 0.0 110.331 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.799 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -98.77 35.43 1.85 Allowed 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.169 -0.957 . . . . 0.0 111.309 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.44 ' HD2' HG22 ' A' ' 53' ' ' THR . 14.7 t80 -58.83 -57.59 12.34 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 120.973 -1.079 . . . . 0.0 110.144 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -137.7 77.02 1.61 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.162 -0.961 . . . . 0.0 110.292 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -147.24 -59.18 0.27 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.107 -0.996 . . . . 0.0 110.38 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -119.77 -61.33 0.26 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.6 mttt . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.236 -1.156 . . . . 0.0 110.171 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.63 145.0 40.87 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.448 1.236 . . . . 0.0 110.477 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -148.21 140.97 24.62 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.148 -0.97 . . . . 0.0 110.352 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.612 ' HD1' HD13 ' A' ' 13' ' ' LEU . 71.7 t80 -111.86 162.66 15.05 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.269 -0.894 . . . . 0.0 110.01 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -137.75 137.1 37.94 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.033 -1.042 . . . . 0.0 110.853 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.2 t -114.23 100.74 8.58 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.177 -0.952 . . . . 0.0 109.91 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -58.09 -37.08 73.83 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.098 -1.002 . . . . 0.0 110.704 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -61.4 -34.96 76.23 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 120.996 -1.065 . . . . 0.0 110.046 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 35.6 m -90.03 -4.12 57.58 Favored 'General case' 0 N--CA 1.505 2.299 0 O-C-N 121.095 -1.003 . . . . 0.0 111.826 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.9 t70 53.74 39.4 30.21 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.393 -1.442 . . . . 0.0 110.473 -179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 t -142.18 171.89 13.44 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.279 -0.888 . . . . 0.0 109.995 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.4 120.81 37.99 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.243 -0.911 . . . . 0.0 110.086 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.612 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -74.7 166.91 22.81 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.13 -0.981 . . . . 0.0 109.559 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.497 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -101.12 -29.44 12.13 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.106 -0.996 . . . . 0.0 111.889 -179.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.591 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.4 m-70 -114.62 148.11 38.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 120.782 -1.199 . . . . 0.0 110.342 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -124.59 97.52 5.33 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.203 -0.936 . . . . 0.0 109.764 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.29 178.08 1.56 Allowed Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.226 -0.921 . . . . 0.0 110.263 -179.631 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -70.56 -30.67 18.24 Favored 'Trans proline' 0 C--N 1.316 -1.178 0 O-C-N 123.405 1.213 . . . . 0.0 110.93 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.7 m -90.32 -39.78 12.52 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 120.978 -1.076 . . . . 0.0 109.989 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.591 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.5 t -60.2 -52.34 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.614 0 O-C-N 121.034 -1.041 . . . . 0.0 109.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 29.3 mtp180 -57.61 -49.39 76.56 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 121.13 -0.981 . . . . 0.0 109.583 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -41.4 99.09 Favored 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 119.321 -0.952 . . . . 0.0 108.728 178.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 78.8 m -54.59 -43.33 72.05 Favored 'General case' 0 N--CA 1.512 2.646 0 O-C-N 121.157 -0.964 . . . . 0.0 108.493 178.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.87 -37.16 85.76 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.648 -0.821 . . . . 0.0 109.062 178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 50.32 1.04 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.206 -0.934 . . . . 0.0 110.331 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.22 38.11 3.32 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.057 -1.027 . . . . 0.0 110.382 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.34 126.41 2.39 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.836 -1.305 . . . . 0.0 109.836 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 tpp85 -53.75 -28.92 37.35 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.211 -1.17 . . . . 0.0 110.263 179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -59.13 -32.74 70.12 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.05 -1.031 . . . . 0.0 110.605 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.499 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.54 -37.08 25.6 Favored 'General case' 0 N--CA 1.516 2.829 0 O-C-N 120.92 -1.112 . . . . 0.0 111.043 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 tttm -60.67 -53.62 55.27 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.071 -1.018 . . . . 0.0 109.157 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.3 -39.03 85.52 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.181 -0.95 . . . . 0.0 109.03 178.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -56.03 -37.16 68.83 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.281 -0.887 . . . . 0.0 110.18 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.852 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.3 t -58.83 -37.2 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.06 -1.025 . . . . 0.0 109.796 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CZ ' ' A' ' 38' ' ' TYR . 9.0 tttp -54.76 -40.83 69.77 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 120.93 -1.106 . . . . 0.0 109.716 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -59.59 -32.4 70.35 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.95 178.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -65.51 -51.32 60.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.997 -1.064 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.656 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.8 p90 -99.87 34.21 2.35 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.06 -1.025 . . . . 0.0 111.323 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -87.01 -39.21 15.87 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.813 -1.179 . . . . 0.0 109.733 178.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -114.27 34.55 4.63 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.237 -0.914 . . . . 0.0 110.358 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.459 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.6 t90 -88.5 -47.61 8.2 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.181 -0.949 . . . . 0.0 110.162 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.459 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -151.98 -64.18 0.17 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.182 -0.949 . . . . 0.0 110.639 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -129.24 -171.48 2.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.221 -0.924 . . . . 0.0 110.147 -179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -109.52 -179.74 3.91 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.22 -0.925 . . . . 0.0 110.14 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tp60 53.27 74.56 0.3 Allowed 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.121 -0.987 . . . . 0.0 110.687 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.443 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -135.23 73.5 1.48 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.271 -0.893 . . . . 0.0 110.166 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -112.18 35.19 3.86 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.203 -0.936 . . . . 0.0 110.499 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.09 -54.21 2.56 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.054 -1.029 . . . . 0.0 109.325 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.88 -21.24 63.1 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.268 -0.895 . . . . 0.0 111.334 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.628 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -74.05 -43.31 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.646 -1.284 . . . . 0.0 109.536 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.463 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 20.0 m-20 -64.53 -39.97 94.76 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.234 -0.916 . . . . 0.0 109.978 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 mtpt -63.58 -33.64 76.05 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.229 -0.92 . . . . 0.0 110.744 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.4 m -90.03 -39.15 13.12 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.066 -1.021 . . . . 0.0 110.39 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.463 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 5.5 p -57.84 -38.73 76.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.025 -1.047 . . . . 0.0 110.258 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.89 -48.51 81.4 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.167 -0.958 . . . . 0.0 109.954 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.4 76.38 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.221 -0.924 . . . . 0.0 110.238 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -51.64 -37.02 48.44 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 121.058 -1.026 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -131.68 76.69 1.72 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.123 -0.986 . . . . 0.0 110.152 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -109.59 -53.05 2.71 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.204 -0.935 . . . . 0.0 110.303 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 142.21 109.46 0.74 Allowed Glycine 0 N--CA 1.495 2.581 0 N-CA-C 109.741 -1.344 . . . . 0.0 109.741 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.727 0 O-C-N 121.255 -1.144 . . . . 0.0 110.234 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtt . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.11 125.5 9.84 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.424 1.223 . . . . 0.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.9 mttt 56.26 168.08 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.297 -0.877 . . . . 0.0 110.733 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.58 ' HD2' HD13 ' A' ' 13' ' ' LEU . 79.9 t80 -124.89 162.21 24.9 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.11 -0.994 . . . . 0.0 109.912 -179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -139.7 132.43 29.01 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.231 -0.918 . . . . 0.0 110.434 -179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 22.0 t -112.84 89.88 3.2 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.204 -0.935 . . . . 0.0 109.973 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -51.31 -35.77 39.41 Favored 'General case' 0 N--CA 1.515 2.82 0 O-C-N 121.05 -1.031 . . . . 0.0 110.455 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.897 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.0 m-85 -59.92 -31.0 69.42 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.117 -0.99 . . . . 0.0 110.063 178.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 31.3 m -99.41 -0.15 41.48 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.929 -1.107 . . . . 0.0 112.239 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 52.84 38.41 26.63 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.326 -1.484 . . . . 0.0 110.656 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -142.16 170.46 15.67 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.224 -0.923 . . . . 0.0 110.022 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -121.45 142.92 49.56 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.212 -0.93 . . . . 0.0 110.765 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.58 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -102.73 156.58 17.54 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.251 -0.906 . . . . 0.0 109.406 179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.419 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -98.86 -30.83 12.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.13 -0.981 . . . . 0.0 111.594 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.456 ' O ' HG11 ' A' ' 20' ' ' VAL . 36.7 m-70 -111.19 126.93 55.38 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.814 -1.179 . . . . 0.0 110.175 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -110.03 92.52 4.08 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.237 -0.915 . . . . 0.0 109.647 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.45 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -135.61 -179.72 1.15 Allowed Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.43 -0.794 . . . . 0.0 109.765 -179.59 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.45 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.72 -28.35 17.13 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.355 1.187 . . . . 0.0 111.185 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.84 -43.55 9.97 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 120.881 -1.137 . . . . 0.0 110.07 179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.456 HG11 ' O ' ' A' ' 15' ' ' HIS . 90.5 t -59.14 -53.29 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.57 0 O-C-N 121.039 -1.038 . . . . 0.0 109.838 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.95 -50.14 73.54 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.074 -1.016 . . . . 0.0 109.625 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 mttt -61.91 -40.8 96.7 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.133 -0.98 . . . . 0.0 108.741 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.6 m -54.56 -43.43 72.03 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.075 -1.016 . . . . 0.0 108.496 178.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -63.35 -40.91 98.57 Favored 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -93.25 56.61 2.53 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.342 -0.849 . . . . 0.0 110.197 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -119.11 37.09 4.23 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.131 -0.981 . . . . 0.0 110.401 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.29 123.37 1.74 Allowed Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -51.12 -30.39 16.18 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.204 -1.174 . . . . 0.0 110.672 179.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 38.4 mtpt -57.66 -33.79 68.7 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.013 -1.054 . . . . 0.0 110.596 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.49 -42.43 54.68 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.92 -1.113 . . . . 0.0 110.728 -179.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -62.97 -53.31 56.07 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.107 -0.996 . . . . 0.0 109.055 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.68 88.89 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.232 -0.918 . . . . 0.0 109.04 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.5 m-20 -55.66 -38.61 69.82 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.215 -0.928 . . . . 0.0 110.024 179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.897 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.4 t -61.62 -38.76 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 121.176 -0.952 . . . . 0.0 109.662 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 12.8 mtmt -58.45 -45.24 88.96 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.053 -1.029 . . . . 0.0 109.395 179.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.92 -25.66 63.66 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.274 -0.891 . . . . 0.0 110.362 178.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -72.9 -50.78 21.62 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 120.84 -1.162 . . . . 0.0 110.583 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.516 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 37.6 p90 -99.85 34.88 2.15 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.994 -1.067 . . . . 0.0 111.464 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -38.96 14.22 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.769 -1.207 . . . . 0.0 109.871 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.42 32.02 6.07 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.268 -0.895 . . . . 0.0 110.663 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 17.4 t90 -85.39 -37.93 19.29 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.126 -0.984 . . . . 0.0 110.315 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.453 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.9 mtm -142.48 -67.36 0.38 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.103 -0.998 . . . . 0.0 110.206 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -156.98 38.82 0.31 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.095 -1.003 . . . . 0.0 110.812 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 52.05 38.33 23.74 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.087 -1.008 . . . . 0.0 110.932 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -134.37 74.8 1.55 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.104 -0.997 . . . . 0.0 110.2 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.516 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -154.83 73.44 0.89 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.199 -0.938 . . . . 0.0 110.687 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.45 35.15 4.34 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.947 . . . . 0.0 110.627 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 5.4 t -109.86 -54.74 2.53 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.154 -0.966 . . . . 0.0 109.369 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.12 -20.01 64.97 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.282 -0.886 . . . . 0.0 111.365 179.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.812 HD12 HG11 ' A' ' 34' ' ' VAL . 50.0 mm -74.64 -41.09 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 120.698 -1.251 . . . . 0.0 109.914 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.423 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 3.5 t70 -67.29 -39.62 86.02 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.245 -0.909 . . . . 0.0 110.146 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -56.3 -37.09 69.42 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.095 -1.003 . . . . 0.0 110.47 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.0 m -92.1 -36.29 13.42 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.227 -0.921 . . . . 0.0 110.567 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.627 HG23 ' O ' ' A' ' 50' ' ' ILE . 68.1 p -76.78 -42.72 39.68 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.077 -1.014 . . . . 0.0 110.115 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.21 -40.55 94.41 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.215 -0.928 . . . . 0.0 110.0 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.93 30.21 3.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.115 -0.991 . . . . 0.0 111.595 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.92 -58.31 2.37 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 120.844 -1.16 . . . . 0.0 110.073 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -143.91 78.31 1.58 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.165 -0.96 . . . . 0.0 110.224 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.1 tp60 -118.72 66.27 0.77 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.093 -1.004 . . . . 0.0 110.161 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.71 43.36 1.74 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt . . . . . 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.208 . . . . 0.0 110.171 -179.933 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.6 ttm . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.68 79.62 1.87 Allowed 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.411 1.216 . . . . 0.0 110.481 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 41.6 mttt -122.44 146.54 47.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.147 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.648 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.8 t80 -111.6 161.85 15.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.176 -0.953 . . . . 0.0 110.328 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -129.04 139.28 52.11 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.268 -0.895 . . . . 0.0 110.146 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 44.1 t -118.21 98.35 6.25 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.131 -0.981 . . . . 0.0 109.912 179.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -51.98 -36.05 48.47 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 121.033 -1.042 . . . . 0.0 110.75 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.817 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.2 m-85 -63.48 -30.92 71.96 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.036 -1.04 . . . . 0.0 110.254 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.0 m -99.46 -11.11 21.39 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.981 -1.075 . . . . 0.0 112.03 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.5 t0 56.72 40.89 28.93 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 120.409 -1.432 . . . . 0.0 110.076 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -141.56 172.95 11.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.248 -0.907 . . . . 0.0 110.055 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.44 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.5 t80 -119.92 128.41 53.59 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.304 -0.873 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.648 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.2 mp -82.27 169.75 16.17 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.2 -0.937 . . . . 0.0 109.732 179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -97.43 -31.99 12.08 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.169 -0.957 . . . . 0.0 111.346 -179.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 39.1 m-70 -116.04 137.6 51.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.91 -1.118 . . . . 0.0 110.126 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -114.19 96.44 5.8 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.209 -0.932 . . . . 0.0 109.838 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.36 177.96 1.61 Allowed Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.256 -0.902 . . . . 0.0 110.172 -179.707 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.6 Cg_endo -71.02 -31.21 15.34 Favored 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.372 1.196 . . . . 0.0 111.082 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 36.6 m -87.2 -39.76 15.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.912 -1.117 . . . . 0.0 110.084 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.433 HG11 ' O ' ' A' ' 15' ' ' HIS . 86.2 t -61.02 -47.81 91.9 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.226 -0.921 . . . . 0.0 109.716 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 20.5 mtt180 -57.53 -53.73 54.81 Favored 'General case' 0 N--CA 1.512 2.642 0 O-C-N 121.146 -0.972 . . . . 0.0 109.725 179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp -60.61 -40.08 90.54 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.191 -0.943 . . . . 0.0 109.009 178.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 95.1 m -56.22 -43.44 78.56 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.083 -1.011 . . . . 0.0 108.421 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 67.6 t60 -61.32 -36.87 81.34 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.028 177.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -97.48 49.38 1.04 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.146 -0.971 . . . . 0.0 110.389 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.82 37.76 3.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.12 -0.988 . . . . 0.0 110.284 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -141.61 129.51 4.02 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -54.42 -28.57 44.85 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.152 -1.205 . . . . 0.0 110.481 179.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -61.2 -35.16 76.43 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.996 -1.065 . . . . 0.0 110.503 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.491 ' O ' HG23 ' A' ' 34' ' ' VAL . 10.0 t-80 -51.68 -38.45 55.07 Favored 'General case' 0 N--CA 1.514 2.728 0 O-C-N 120.908 -1.12 . . . . 0.0 110.599 -179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -61.6 -55.74 27.41 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.114 -0.991 . . . . 0.0 109.245 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -58.97 -38.51 79.27 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.206 -0.934 . . . . 0.0 109.173 178.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.18 -38.33 70.79 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.163 -0.961 . . . . 0.0 110.128 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.854 ' CG1' HD12 ' A' ' 50' ' ' ILE . 98.2 t -63.52 -36.85 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.099 -1.001 . . . . 0.0 109.847 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -52.53 -40.58 62.62 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.007 -1.058 . . . . 0.0 109.821 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -57.71 -30.14 65.28 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.314 -0.866 . . . . 0.0 110.316 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -69.46 -53.48 19.03 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 120.885 -1.134 . . . . 0.0 109.946 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 38.5 p90 -100.11 34.39 2.34 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 111.198 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -76.77 -36.96 56.68 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 120.781 -1.199 . . . . 0.0 110.341 179.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.21 22.99 13.1 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.101 -0.999 . . . . 0.0 111.294 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.469 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.8 t90 -104.89 -49.46 3.49 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 120.865 -1.147 . . . . 0.0 110.238 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 46' ' ' ALA . 0.0 OUTLIER -103.54 -46.7 4.48 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.127 -0.983 . . . . 0.0 110.299 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 53.7 38.5 28.55 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.984 -1.073 . . . . 0.0 110.775 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -156.93 -65.82 0.1 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.252 -0.905 . . . . 0.0 110.634 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -164.69 77.68 0.33 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.18 -0.95 . . . . 0.0 110.788 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.54 ' HB2' ' HG2' ' A' ' 42' ' ' MET . . . -122.84 73.7 1.16 Allowed 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.166 -0.959 . . . . 0.0 110.431 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -121.1 35.9 4.76 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.284 -0.885 . . . . 0.0 110.388 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 33.0 m -111.21 -52.9 2.75 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.106 -0.996 . . . . 0.0 109.798 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.2 -21.3 61.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.134 -0.979 . . . . 0.0 111.551 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.854 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.4 mm -70.75 -38.61 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 120.719 -1.238 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -86.62 -39.97 15.6 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.106 -0.996 . . . . 0.0 110.065 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -64.27 -31.79 73.13 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.222 -0.924 . . . . 0.0 110.652 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.3 m -87.38 -44.94 10.99 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.964 -1.085 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 50' ' ' ILE . 16.9 p -56.04 -35.68 67.15 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 121.093 -1.004 . . . . 0.0 110.688 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.64 -39.75 15.79 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.062 -1.024 . . . . 0.0 109.919 179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.59 -36.99 85.36 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.111 -0.993 . . . . 0.0 110.162 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.67 -38.47 55.09 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.964 -1.085 . . . . 0.0 110.607 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -107.37 -50.98 2.98 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.147 -0.971 . . . . 0.0 110.391 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -113.2 66.4 0.65 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.097 -1.002 . . . . 0.0 110.259 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.02 -74.79 0.68 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.3 tttt . . . . . 0 N--CA 1.495 1.777 0 O-C-N 121.254 -1.145 . . . . 0.0 110.211 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.55 142.51 36.55 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.382 1.201 . . . . 0.0 110.433 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.2 mttp 55.79 170.46 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.213 -0.929 . . . . 0.0 110.636 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -126.38 162.36 25.72 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.103 -0.998 . . . . 0.0 110.093 -179.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.9 t80 -141.25 132.01 25.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.171 -0.956 . . . . 0.0 110.393 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.4 t -110.63 88.87 2.88 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.203 -0.935 . . . . 0.0 109.553 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -50.96 -36.48 39.15 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.153 -0.967 . . . . 0.0 111.058 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.975 ' CD2' HG13 ' A' ' 34' ' ' VAL . 26.6 m-85 -61.79 -30.55 70.89 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.041 -1.037 . . . . 0.0 110.127 179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 56.0 m -98.15 -0.88 43.46 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 120.997 -1.064 . . . . 0.0 111.997 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 53.01 38.27 26.82 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.423 -1.423 . . . . 0.0 110.791 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.9 t -139.59 168.05 20.7 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.155 -0.966 . . . . 0.0 109.872 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -120.91 143.77 48.78 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.155 -0.966 . . . . 0.0 110.637 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -106.25 140.23 39.51 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.226 -0.921 . . . . 0.0 109.535 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.6 t -102.33 -21.03 14.38 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.074 -1.016 . . . . 0.0 112.441 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.555 ' CB ' HG21 ' A' ' 20' ' ' VAL . 40.0 m-70 -103.58 67.49 0.9 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.636 -1.29 . . . . 0.0 110.02 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -59.44 101.7 0.11 Allowed 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.24 -0.912 . . . . 0.0 110.038 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.72 178.18 1.57 Allowed Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.026 -1.046 . . . . 0.0 110.251 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.88 -30.17 17.46 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 O-C-N 123.403 1.212 . . . . 0.0 110.942 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 40.3 m -90.26 -40.77 11.96 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.888 -1.133 . . . . 0.0 109.961 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.555 HG21 ' CB ' ' A' ' 15' ' ' HIS . 98.1 t -59.6 -56.16 19.06 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.626 0 O-C-N 121.053 -1.029 . . . . 0.0 109.75 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 51.7 mtp85 -55.27 -50.28 69.92 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.072 -1.017 . . . . 0.0 109.899 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -62.34 -40.64 97.04 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.285 -0.966 . . . . 0.0 108.802 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 52.9 m -55.5 -43.08 75.32 Favored 'General case' 0 N--CA 1.512 2.634 0 O-C-N 121.097 -1.002 . . . . 0.0 108.368 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -64.73 -37.79 88.78 Favored 'General case' 0 N--CA 1.502 2.135 0 C-N-CA 119.6 -0.84 . . . . 0.0 108.953 178.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -97.63 57.0 1.33 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.171 -0.956 . . . . 0.0 110.2 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.13 37.73 3.24 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.129 -0.982 . . . . 0.0 110.443 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -155.13 122.69 1.25 Allowed Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.11 -1.196 . . . . 0.0 110.11 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.84 -29.61 28.88 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.091 -1.241 . . . . 0.0 110.134 178.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -56.78 -31.99 65.21 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.084 -1.01 . . . . 0.0 110.772 179.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 33.9 t-80 -47.34 -38.64 13.29 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.132 -0.98 . . . . 0.0 111.306 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -55.06 26.74 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.006 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -59.49 -39.1 82.68 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.183 -0.948 . . . . 0.0 109.092 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -54.64 -36.38 64.47 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.194 -0.941 . . . . 0.0 110.261 179.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.975 HG13 ' CD2' ' A' ' 8' ' ' TYR . 89.1 t -55.34 -37.81 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.514 2.733 0 O-C-N 121.056 -1.027 . . . . 0.0 110.093 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 7.1 tttp -54.26 -39.67 67.07 Favored 'General case' 0 N--CA 1.514 2.737 0 O-C-N 121.073 -1.017 . . . . 0.0 109.894 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -59.8 -32.26 70.47 Favored 'General case' 0 N--CA 1.505 2.298 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.036 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.441 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 33.5 t80 -64.87 -52.17 58.06 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.954 -1.091 . . . . 0.0 110.169 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.535 ' HE2' HG12 ' A' ' 34' ' ' VAL . 49.3 p90 -100.38 34.69 2.31 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.097 -1.002 . . . . 0.0 111.15 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.99 -39.6 14.56 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.736 -1.228 . . . . 0.0 109.788 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -115.36 34.47 4.87 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.247 -0.908 . . . . 0.0 110.415 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.486 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.7 t90 -93.5 -38.82 11.21 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.153 -0.967 . . . . 0.0 110.273 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.486 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.3 ttm -145.87 -62.19 0.33 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.177 -0.952 . . . . 0.0 110.392 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -143.35 -164.46 1.87 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.182 -0.949 . . . . 0.0 110.05 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.29 39.26 2.34 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.111 -0.993 . . . . 0.0 110.201 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -150.41 75.1 1.21 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.312 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.47 72.1 1.39 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.214 -0.928 . . . . 0.0 110.181 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -117.06 35.92 4.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.343 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -110.28 -54.94 2.52 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.147 -0.97 . . . . 0.0 109.309 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.68 -21.06 64.12 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.204 -0.935 . . . . 0.0 111.208 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.587 HD12 HG11 ' A' ' 34' ' ' VAL . 48.3 mm -74.36 -54.59 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 O-C-N 120.653 -1.28 . . . . 0.0 109.517 179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 5.3 t0 -55.56 -39.67 70.94 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.14 -0.975 . . . . 0.0 110.3 -179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.81 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 14.7 tttt -59.74 -37.15 78.15 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.128 -0.983 . . . . 0.0 110.304 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.2 m -90.85 -40.52 11.71 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.064 -1.022 . . . . 0.0 110.076 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 66.8 p -68.27 -35.84 78.5 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.207 -0.933 . . . . 0.0 110.198 179.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 51' ' ' ASP . . . -90.79 -41.62 11.13 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.038 -1.038 . . . . 0.0 110.024 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.81 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -98.5 31.75 2.75 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.171 -0.956 . . . . 0.0 111.428 179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.28 -58.35 8.65 Favored 'General case' 0 N--CA 1.51 2.558 0 O-C-N 120.961 -1.087 . . . . 0.0 109.863 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 52.25 39.07 26.34 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.096 -1.003 . . . . 0.0 110.954 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 52.27 39.3 26.85 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.001 -1.062 . . . . 0.0 110.782 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -81.28 -76.17 1.07 Allowed Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt . . . . . 0 N--CA 1.494 1.763 0 O-C-N 121.202 -1.175 . . . . 0.0 110.2 -179.977 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.4 ttm . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.91 110.45 3.04 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.29 1.153 . . . . 0.0 110.3 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 5.7 mttt -129.19 150.97 50.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.195 -0.94 . . . . 0.0 110.097 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.652 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.9 t80 -110.72 161.49 15.71 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.128 -0.983 . . . . 0.0 110.491 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.441 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 34.7 t80 -135.58 134.58 39.51 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.225 -0.922 . . . . 0.0 110.249 -179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 39.3 t -114.27 96.67 5.91 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.125 -0.984 . . . . 0.0 110.1 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -53.52 -36.2 61.5 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.075 -1.016 . . . . 0.0 110.468 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.706 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -61.45 -32.76 72.75 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.138 -0.976 . . . . 0.0 110.074 179.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.9 m -96.51 -5.33 39.68 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.996 -1.065 . . . . 0.0 112.187 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 53.44 39.86 30.53 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.441 -1.412 . . . . 0.0 110.388 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -141.62 172.09 13.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.332 -0.855 . . . . 0.0 109.956 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.431 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 13.0 t80 -119.41 137.89 53.46 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.315 -0.866 . . . . 0.0 110.479 -179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.652 HD13 ' HD1' ' A' ' 4' ' ' PHE . 2.9 mp -96.59 168.29 10.62 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.237 -0.915 . . . . 0.0 109.587 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.513 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.2 t -98.88 -30.13 12.56 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.166 -0.958 . . . . 0.0 111.777 -179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.587 ' HB2' HG11 ' A' ' 20' ' ' VAL . 49.5 m-70 -113.06 148.73 34.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 120.909 -1.119 . . . . 0.0 110.413 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -126.56 96.88 4.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.338 -0.851 . . . . 0.0 109.678 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -150.46 178.5 1.49 Allowed Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.258 -0.901 . . . . 0.0 110.283 -179.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.6 Cg_endo -70.43 -32.01 16.55 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.37 1.195 . . . . 0.0 110.897 179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.2 m -86.07 -40.34 15.83 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 120.929 -1.107 . . . . 0.0 109.878 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.587 HG11 ' HB2' ' A' ' 15' ' ' HIS . 77.8 t -61.94 -50.2 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.194 -0.941 . . . . 0.0 109.496 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' CD ' ' CE2' ' A' ' 4' ' ' PHE . 36.2 mtm-85 -57.45 -50.24 73.67 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.119 -0.988 . . . . 0.0 109.49 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -61.49 -40.91 96.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.139 -0.976 . . . . 0.0 108.674 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.1 m -54.57 -43.69 72.29 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 121.122 -0.987 . . . . 0.0 108.463 178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -62.77 -39.99 95.89 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.4 t -93.07 55.75 2.4 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.267 -0.896 . . . . 0.0 110.35 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.89 37.29 4.25 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.063 -1.023 . . . . 0.0 110.29 179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.87 126.95 2.76 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -28.3 42.98 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.126 -1.22 . . . . 0.0 110.462 179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -60.94 -32.4 71.92 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.972 -1.08 . . . . 0.0 110.708 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.553 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.7 t-80 -50.22 -39.95 45.98 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.946 -1.096 . . . . 0.0 110.75 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.39 -52.81 60.1 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.071 -1.018 . . . . 0.0 108.89 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -61.26 -39.73 91.45 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.481 -0.888 . . . . 0.0 108.918 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -56.29 -38.56 71.39 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.237 -0.915 . . . . 0.0 109.981 179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.706 HG13 ' CD2' ' A' ' 8' ' ' TYR . 73.5 t -56.84 -35.47 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.646 0 O-C-N 121.091 -1.005 . . . . 0.0 110.027 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.0 tttt -53.07 -42.82 66.22 Favored 'General case' 0 N--CA 1.513 2.702 0 O-C-N 120.999 -1.063 . . . . 0.0 109.935 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -57.51 -31.35 65.94 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.196 179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -64.31 -51.3 64.13 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 120.991 -1.068 . . . . 0.0 110.148 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' HE1' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -100.37 33.62 2.63 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.152 -0.967 . . . . 0.0 111.352 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.4 tt0 -91.16 -38.52 12.68 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 120.801 -1.187 . . . . 0.0 110.054 178.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -111.28 29.11 8.1 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.221 -0.924 . . . . 0.0 110.894 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.503 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 25.9 t90 -92.56 -40.07 11.0 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.002 -1.061 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.503 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.0 tpp -145.8 -60.4 0.33 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.073 -1.017 . . . . 0.0 110.286 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -146.32 -164.63 2.02 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.199 -0.938 . . . . 0.0 110.242 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -109.89 39.39 2.14 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.198 -0.939 . . . . 0.0 110.134 179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -152.0 75.89 1.16 Allowed 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.158 -0.964 . . . . 0.0 110.36 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -138.94 74.29 1.47 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.237 -0.914 . . . . 0.0 110.272 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -111.89 35.86 3.54 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.191 -0.943 . . . . 0.0 110.341 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.4 p -110.48 -53.78 2.65 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.172 -0.955 . . . . 0.0 109.547 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.31 63.3 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.252 -0.905 . . . . 0.0 111.322 179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.653 HD12 HG11 ' A' ' 34' ' ' VAL . 48.1 mm -73.27 -54.5 15.41 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 O-C-N 120.61 -1.306 . . . . 0.0 109.552 179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -57.29 -39.49 75.83 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.185 -0.947 . . . . 0.0 110.343 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 18.0 mtpt -63.85 -35.08 79.46 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.218 -0.926 . . . . 0.0 110.458 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.494 HG22 ' CD1' ' A' ' 57' ' ' PHE . 42.5 m -90.4 -46.93 8.05 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.028 -1.045 . . . . 0.0 110.235 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 44.5 p -55.45 -34.43 64.5 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.069 -1.019 . . . . 0.0 110.698 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -87.93 -36.99 16.8 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.046 -1.034 . . . . 0.0 110.33 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.441 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -98.12 37.18 1.46 Allowed 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.001 -1.062 . . . . 0.0 111.131 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.494 ' CD1' HG22 ' A' ' 53' ' ' THR . 1.1 t80 -91.55 -39.17 12.06 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.95 -1.094 . . . . 0.0 110.16 179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -113.74 65.83 0.66 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.156 -0.965 . . . . 0.0 110.243 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 23.2 mm100 -120.32 40.36 3.49 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.107 -0.995 . . . . 0.0 110.171 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -101.32 59.99 0.61 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.629 -1.388 . . . . 0.0 109.629 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.8 pttp . . . . . 0 N--CA 1.496 1.837 0 O-C-N 121.239 -1.154 . . . . 0.0 110.283 179.997 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.755 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.62 148.04 46.66 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.374 1.197 . . . . 0.0 110.529 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt -143.92 158.95 43.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.245 -0.909 . . . . 0.0 110.247 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.472 ' HD1' HD13 ' A' ' 13' ' ' LEU . 62.6 t80 -115.08 154.68 28.46 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.192 -0.943 . . . . 0.0 109.868 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.406 ' CD1' ' O ' ' A' ' 11' ' ' THR . 66.2 t80 -130.93 141.03 50.25 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.007 -1.058 . . . . 0.0 110.563 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.2 t -119.15 92.61 3.84 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.289 -0.882 . . . . 0.0 109.793 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -53.09 -36.48 60.75 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.093 -1.005 . . . . 0.0 111.064 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.791 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.0 m-85 -62.15 -32.58 73.2 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 120.997 -1.064 . . . . 0.0 109.957 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 45.9 m -94.73 -1.33 53.2 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 120.989 -1.069 . . . . 0.0 111.934 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.88 38.27 28.34 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.304 -1.498 . . . . 0.0 110.439 -179.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.406 ' O ' ' CD1' ' A' ' 5' ' ' TYR . 8.3 t -143.38 171.53 14.0 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.164 -0.96 . . . . 0.0 110.011 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.402 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.7 OUTLIER -129.86 131.26 46.04 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.912 . . . . 0.0 109.954 -179.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.472 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.5 mp -87.99 161.67 17.27 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.117 -0.989 . . . . 0.0 110.145 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 13.7 t -97.22 -29.98 13.26 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.998 -1.064 . . . . 0.0 111.6 -179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.428 ' HB2' HG11 ' A' ' 20' ' ' VAL . 47.9 m-70 -106.88 130.77 54.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.903 -1.123 . . . . 0.0 109.974 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -114.18 76.89 1.01 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.165 -0.959 . . . . 0.0 110.002 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.409 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -119.87 -179.11 0.65 Allowed Pre-proline 0 N--CA 1.492 1.642 0 O-C-N 121.278 -0.889 . . . . 0.0 109.934 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 44.9 Cg_endo -72.83 -26.56 15.6 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.292 1.154 . . . . 0.0 111.507 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.1 t -92.06 -42.71 9.81 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.752 -1.218 . . . . 0.0 110.196 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 15' ' ' HIS . 81.4 t -57.82 -53.12 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.61 0 O-C-N 121.072 -1.018 . . . . 0.0 109.932 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 30.6 mtp180 -55.98 -51.12 68.84 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.023 -1.048 . . . . 0.0 109.809 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 tttt -61.98 -40.8 96.85 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.143 -0.973 . . . . 0.0 108.728 178.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.5 m -54.64 -43.03 71.96 Favored 'General case' 0 N--CA 1.512 2.656 0 O-C-N 121.215 -0.928 . . . . 0.0 108.504 178.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.4 t60 -62.88 -37.8 88.34 Favored 'General case' 0 N--CA 1.502 2.171 0 C-N-CA 119.627 -0.829 . . . . 0.0 108.979 177.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.3 t -97.26 51.39 1.1 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.224 -0.922 . . . . 0.0 110.2 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.32 37.99 3.37 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.355 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.4 127.76 2.84 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.0 tpt180 -54.52 -28.33 44.57 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.205 -1.173 . . . . 0.0 110.496 179.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 32.2 tttp -61.12 -33.15 72.92 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.88 -1.138 . . . . 0.0 110.669 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.529 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.6 t-80 -50.33 -41.34 51.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.933 -1.105 . . . . 0.0 110.87 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -61.79 -56.08 23.27 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 119.295 -0.962 . . . . 0.0 109.236 179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -59.0 -38.02 78.23 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.159 -0.963 . . . . 0.0 109.157 178.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -56.35 -39.35 72.73 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.113 -0.992 . . . . 0.0 110.041 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.791 HG13 ' CD1' ' A' ' 8' ' ' TYR . 84.2 t -62.86 -39.28 84.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 109.544 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -59.59 -42.45 92.6 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.058 -1.026 . . . . 0.0 109.215 179.131 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -59.42 -31.48 69.31 Favored 'General case' 0 N--CA 1.507 2.398 0 C-N-CA 119.491 -0.884 . . . . 0.0 110.062 178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -69.85 -51.73 30.97 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.922 -1.111 . . . . 0.0 110.249 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.718 ' HE2' HG12 ' A' ' 34' ' ' VAL . 42.3 p90 -99.88 33.89 2.44 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.073 -1.017 . . . . 0.0 111.34 179.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.22 -39.73 17.46 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 120.78 -1.2 . . . . 0.0 109.874 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.0 tttt -90.34 -29.65 17.94 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.25 -0.906 . . . . 0.0 110.372 179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.454 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.1 t90 -46.6 -33.89 4.53 Favored 'General case' 0 N--CA 1.515 2.781 0 O-C-N 121.086 -1.009 . . . . 0.0 111.788 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.454 ' HE1' ' CZ2' ' A' ' 41' ' ' TRP . 1.5 mtt -151.77 -55.22 0.14 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.992 -1.068 . . . . 0.0 111.198 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 59.26 40.08 21.82 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.902 -1.124 . . . . 0.0 110.027 -179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -147.41 85.91 1.6 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.224 -0.922 . . . . 0.0 110.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 53.55 74.22 0.33 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.001 -1.062 . . . . 0.0 110.635 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -143.4 69.45 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.21 -0.931 . . . . 0.0 110.207 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -129.95 32.75 4.5 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.258 -0.901 . . . . 0.0 110.634 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.6 m -102.89 -48.21 4.14 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.055 -1.028 . . . . 0.0 109.605 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.13 -21.64 61.84 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.184 -0.948 . . . . 0.0 111.42 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.785 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -83.47 -40.84 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.368 0 O-C-N 120.601 -1.312 . . . . 0.0 109.938 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -58.72 -40.35 83.47 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.168 -0.958 . . . . 0.0 110.09 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.2 mtmt -56.31 -35.51 67.62 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.153 -0.967 . . . . 0.0 110.581 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 80.1 m -90.83 -35.93 14.51 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.047 -1.033 . . . . 0.0 110.531 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.444 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 73.0 p -77.04 -40.27 46.99 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.986 -1.071 . . . . 0.0 110.04 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.45 -40.01 89.59 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.177 -0.952 . . . . 0.0 109.955 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -53.59 -34.4 58.26 Favored 'General case' 0 N--CA 1.513 2.698 0 O-C-N 121.071 -1.018 . . . . 0.0 110.874 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -89.05 -35.93 16.07 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.993 -1.067 . . . . 0.0 110.42 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -76.23 -39.79 53.66 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.981 -1.074 . . . . 0.0 110.02 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -117.54 62.12 0.75 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.123 -0.986 . . . . 0.0 110.21 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -104.24 -109.01 3.35 Favored Glycine 0 N--CA 1.493 2.446 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.3 ttpt . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.245 -1.15 . . . . 0.0 110.208 -179.996 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.85 77.61 2.27 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.493 1.26 . . . . 0.0 110.39 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -142.15 130.37 22.18 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.194 -0.941 . . . . 0.0 109.883 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CD1' ' HD3' ' A' ' 21' ' ' ARG . 47.8 t80 -111.1 157.08 20.42 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.131 -0.981 . . . . 0.0 110.144 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -129.72 137.88 50.82 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.201 -0.937 . . . . 0.0 110.31 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.9 t -115.59 96.36 5.59 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.206 -0.934 . . . . 0.0 110.223 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -54.02 -36.35 62.9 Favored 'General case' 0 N--CA 1.513 2.7 0 O-C-N 121.057 -1.027 . . . . 0.0 110.341 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.778 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.7 m-85 -60.26 -33.97 73.07 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.071 -1.018 . . . . 0.0 110.039 179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.413 ' HB3' HG22 ' A' ' 11' ' ' THR . 38.0 m -94.73 0.88 55.36 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.118 -0.989 . . . . 0.0 112.036 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.49 37.56 19.76 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.468 -1.395 . . . . 0.0 110.797 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.413 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.1 t -146.26 171.26 15.22 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.24 -0.913 . . . . 0.0 110.173 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.17 124.55 47.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.043 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.413 HD13 ' CD2' ' A' ' 4' ' ' PHE . 4.5 mp -73.41 167.15 21.85 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.228 -0.92 . . . . 0.0 109.668 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.413 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.0 t -101.12 -28.46 12.68 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.139 -0.976 . . . . 0.0 111.951 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.691 ' HB2' HG11 ' A' ' 20' ' ' VAL . 40.6 m-70 -111.22 144.67 40.0 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.726 -1.234 . . . . 0.0 110.167 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -123.09 92.58 3.73 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.297 -0.877 . . . . 0.0 109.887 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -141.82 178.26 1.59 Allowed Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.243 -0.911 . . . . 0.0 110.047 -179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.43 -30.81 14.8 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.465 1.245 . . . . 0.0 111.082 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 t -89.96 -40.5 12.32 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.947 -1.096 . . . . 0.0 109.991 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.691 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.3 t -58.96 -53.17 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.125 -0.985 . . . . 0.0 109.787 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.425 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 32.9 mtm180 -56.81 -51.57 68.46 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.075 -1.016 . . . . 0.0 109.735 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -61.82 -40.17 94.34 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.286 -0.966 . . . . 0.0 108.968 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.4 -42.61 74.29 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.053 -1.029 . . . . 0.0 108.482 178.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -62.93 -36.35 83.14 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.348 -0.845 . . . . 0.0 109.172 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.69 46.37 0.97 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.172 -0.955 . . . . 0.0 110.448 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.58 38.51 3.25 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.108 -0.995 . . . . 0.0 110.199 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.34 126.49 2.6 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -28.27 45.41 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.185 -1.186 . . . . 0.0 110.287 178.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 18.3 tttm -58.35 -33.95 70.11 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.894 -1.128 . . . . 0.0 110.479 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.584 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.45 -37.65 39.41 Favored 'General case' 0 N--CA 1.516 2.834 0 O-C-N 120.963 -1.086 . . . . 0.0 110.733 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.83 -55.56 28.58 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.027 -1.046 . . . . 0.0 109.126 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.19 -39.25 82.01 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.238 -0.914 . . . . 0.0 109.179 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.53 -37.43 70.45 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.218 -0.926 . . . . 0.0 110.072 179.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.778 HG13 ' CD2' ' A' ' 8' ' ' TYR . 87.2 t -57.9 -37.67 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.023 -1.048 . . . . 0.0 109.944 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 21.0 tttp -54.32 -40.43 67.95 Favored 'General case' 0 N--CA 1.512 2.67 0 O-C-N 120.947 -1.095 . . . . 0.0 109.669 179.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -58.37 -28.97 65.63 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.24 -0.913 . . . . 0.0 110.276 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -70.93 -54.32 11.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.882 -1.136 . . . . 0.0 109.996 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.428 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.6 p90 -99.01 27.77 4.82 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.159 -0.963 . . . . 0.0 111.536 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -62.92 -36.8 84.57 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 120.699 -1.251 . . . . 0.0 110.381 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -109.29 28.51 8.44 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.192 -0.942 . . . . 0.0 111.019 179.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.47 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 18.6 t90 -103.42 -49.77 3.62 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.089 -1.007 . . . . 0.0 110.041 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.47 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 1.3 ttm -148.94 -57.51 0.21 Allowed 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.203 -0.935 . . . . 0.0 110.413 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 55.03 -165.51 0.11 Allowed 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.924 -1.11 . . . . 0.0 110.388 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 53.41 94.27 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.036 -1.04 . . . . 0.0 110.371 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 55.49 69.92 0.69 Allowed 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.979 -1.076 . . . . 0.0 110.338 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.82 69.05 1.07 Allowed 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.239 -0.913 . . . . 0.0 110.375 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -131.6 33.0 4.07 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.285 -0.884 . . . . 0.0 110.71 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 44.8 p -103.76 -49.9 3.54 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.097 -1.002 . . . . 0.0 109.389 179.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.15 -21.11 63.46 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.24 -0.912 . . . . 0.0 111.319 179.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.718 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -82.8 -40.15 16.32 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.37 0 O-C-N 120.723 -1.236 . . . . 0.0 109.951 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.466 ' HA ' ' HG1' ' A' ' 54' ' ' THR . 26.7 t0 -76.58 -40.7 48.8 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.175 -0.953 . . . . 0.0 109.981 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mttp -57.07 -33.33 67.16 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.076 -1.015 . . . . 0.0 110.652 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 78.0 m -90.49 -43.04 10.5 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.968 -1.082 . . . . 0.0 110.34 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.592 HG23 ' O ' ' A' ' 50' ' ' ILE . 41.1 p -60.96 -40.23 92.57 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.084 -1.01 . . . . 0.0 110.004 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.25 92.49 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.209 -0.932 . . . . 0.0 109.976 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -51.75 -32.13 29.52 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.143 -0.973 . . . . 0.0 111.233 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -89.47 -35.08 16.18 Favored 'General case' 0 N--CA 1.506 2.326 0 O-C-N 120.989 -1.069 . . . . 0.0 110.705 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -100.87 -61.6 1.35 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.041 -1.037 . . . . 0.0 110.166 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 52.65 41.26 31.28 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.097 -1.002 . . . . 0.0 110.778 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 139.26 -60.33 0.58 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.115 -1.227 . . . . 0.0 110.13 179.986 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpp? . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.04 108.68 2.65 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 O-C-N 123.392 1.206 . . . . 0.0 110.624 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 9.3 mtmm -139.29 150.05 44.97 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.265 -0.897 . . . . 0.0 110.124 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.53 ' HD2' HD13 ' A' ' 13' ' ' LEU . 89.6 t80 -107.08 161.54 14.66 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.225 -0.922 . . . . 0.0 109.992 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 26.3 t80 -137.76 137.36 38.19 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.114 -0.991 . . . . 0.0 110.222 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.8 t -120.71 92.84 3.86 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.258 -0.901 . . . . 0.0 110.043 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -52.7 -36.16 56.85 Favored 'General case' 0 N--CA 1.513 2.696 0 O-C-N 121.041 -1.037 . . . . 0.0 110.424 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.906 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.6 m-85 -60.13 -33.81 72.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.087 -1.008 . . . . 0.0 110.01 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.8 m -94.21 -2.54 52.34 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.101 -0.999 . . . . 0.0 112.129 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.9 t0 53.57 40.45 31.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 120.38 -1.45 . . . . 0.0 110.554 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 11.8 t -145.93 169.95 17.58 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.246 -0.909 . . . . 0.0 110.328 179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.406 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 23.6 t80 -120.86 140.58 51.58 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.166 -0.959 . . . . 0.0 110.688 -179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.53 HD13 ' HD2' ' A' ' 4' ' ' PHE . 6.2 mp -97.04 164.42 12.53 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.223 -0.923 . . . . 0.0 109.439 179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.587 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.9 t -101.48 -21.83 14.68 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.127 -0.983 . . . . 0.0 112.319 -179.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.587 ' CD2' HG23 ' A' ' 14' ' ' THR . 52.9 m-70 -121.83 137.33 54.82 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.596 -1.315 . . . . 0.0 110.198 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -116.09 88.28 2.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.184 -0.947 . . . . 0.0 109.845 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -132.5 178.54 1.71 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 121.265 -0.897 . . . . 0.0 109.898 -179.617 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -70.88 -28.27 20.09 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.39 1.205 . . . . 0.0 111.285 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.5 m -91.99 -43.17 9.59 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 120.891 -1.131 . . . . 0.0 110.125 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.461 HG11 ' HB2' ' A' ' 15' ' ' HIS . 87.8 t -58.58 -53.34 48.19 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.582 0 O-C-N 121.091 -1.006 . . . . 0.0 109.905 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 4' ' ' PHE . 34.8 mtp180 -56.98 -50.0 74.01 Favored 'General case' 0 N--CA 1.511 2.6 0 O-C-N 121.034 -1.041 . . . . 0.0 109.737 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.32 -40.53 96.62 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.122 -0.986 . . . . 0.0 108.692 178.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.7 m -54.0 -43.02 69.68 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.136 -0.977 . . . . 0.0 108.429 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -63.3 -38.65 91.98 Favored 'General case' 0 N--CA 1.502 2.172 0 C-N-CA 119.565 -0.854 . . . . 0.0 108.822 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -98.57 47.36 0.99 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.206 -0.934 . . . . 0.0 110.466 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.0 m -115.37 40.13 2.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.14 -0.975 . . . . 0.0 109.887 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.68 147.86 19.43 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.884 -1.286 . . . . 0.0 109.884 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.9 ttt85 -76.88 -10.42 59.36 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.258 -1.142 . . . . 0.0 111.22 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -88.36 -26.09 22.39 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 120.652 -1.28 . . . . 0.0 111.079 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.421 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.2 t-80 -49.21 -40.16 32.5 Favored 'General case' 0 N--CA 1.518 2.949 0 O-C-N 120.814 -1.179 . . . . 0.0 110.903 -179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.9 ttmt -62.72 -55.62 25.03 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.104 -0.998 . . . . 0.0 109.101 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.86 -38.65 82.73 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.208 -0.932 . . . . 0.0 109.124 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -56.62 -37.28 70.5 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.14 -0.975 . . . . 0.0 110.094 179.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.906 HG13 ' CD1' ' A' ' 8' ' ' TYR . 47.9 t -55.97 -36.52 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.029 -1.044 . . . . 0.0 109.993 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.4 ttpm? -55.38 -41.1 72.18 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 120.899 -1.125 . . . . 0.0 109.751 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -58.51 -26.05 63.06 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.308 -0.87 . . . . 0.0 110.552 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -73.64 -52.41 13.46 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.819 -1.176 . . . . 0.0 110.438 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.469 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 36.9 p90 -99.08 30.79 3.27 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.036 -1.04 . . . . 0.0 111.517 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -73.98 -41.45 61.9 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.668 -1.27 . . . . 0.0 109.692 179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.09 22.85 11.97 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.314 -0.866 . . . . 0.0 111.117 179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.458 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 24.9 t90 -56.41 -48.84 76.11 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 120.806 -1.184 . . . . 0.0 110.276 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.458 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -139.58 34.74 2.02 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.208 -0.933 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 50.19 37.58 15.09 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.926 -1.109 . . . . 0.0 111.02 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -143.65 -172.84 3.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 110.279 -179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -109.12 114.25 27.81 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.223 -0.923 . . . . 0.0 110.117 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.469 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -113.92 76.59 0.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.286 -0.884 . . . . 0.0 110.216 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -108.85 36.37 2.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.168 -0.958 . . . . 0.0 110.371 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.29 -56.08 2.45 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.204 -0.935 . . . . 0.0 109.424 179.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.03 -20.89 64.42 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.196 -0.94 . . . . 0.0 111.254 179.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.763 HD12 HG11 ' A' ' 34' ' ' VAL . 46.6 mm -69.35 -41.35 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.629 -1.294 . . . . 0.0 109.509 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -76.08 -39.05 56.21 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.281 -0.887 . . . . 0.0 110.007 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.722 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 0.9 OUTLIER -70.62 -34.54 72.22 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.158 -0.964 . . . . 0.0 110.529 179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.5 m -80.75 -40.01 25.93 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.024 -1.048 . . . . 0.0 110.223 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 50' ' ' ILE . 19.6 p -62.83 -37.99 88.98 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.058 -1.026 . . . . 0.0 110.11 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.08 -43.76 9.21 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.119 -0.988 . . . . 0.0 110.183 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -93.9 57.54 2.47 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.139 -0.975 . . . . 0.0 110.186 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -92.5 -38.7 11.8 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.291 -0.881 . . . . 0.0 110.211 179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -129.29 41.95 3.38 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.18 -0.95 . . . . 0.0 110.248 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -142.45 39.94 1.57 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.198 -0.939 . . . . 0.0 110.187 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -141.41 -98.42 0.33 Allowed Glycine 0 N--CA 1.494 2.552 0 N-CA-C 109.641 -1.384 . . . . 0.0 109.641 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.0 mttt . . . . . 0 N--CA 1.494 1.766 0 O-C-N 121.197 -1.178 . . . . 0.0 110.217 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 tpt . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.53 154.72 55.25 Favored 'Trans proline' 0 C--N 1.318 -1.029 0 O-C-N 123.254 1.134 . . . . 0.0 110.453 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt 57.98 160.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.378 -0.826 . . . . 0.0 110.813 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.669 ' HD1' HD13 ' A' ' 13' ' ' LEU . 88.2 t80 -116.72 162.16 18.11 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.993 -1.067 . . . . 0.0 110.353 -179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -135.9 133.84 38.11 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.273 -0.892 . . . . 0.0 110.173 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -113.52 95.53 5.4 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.143 -0.973 . . . . 0.0 110.275 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -52.87 -35.94 58.42 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.065 -1.022 . . . . 0.0 110.34 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.548 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.2 m-85 -60.74 -31.99 71.29 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.136 -0.977 . . . . 0.0 110.11 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.9 m -98.59 -4.96 32.88 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.005 -1.059 . . . . 0.0 112.255 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.3 t0 54.14 39.59 30.85 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.46 -1.4 . . . . 0.0 110.337 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.2 t -142.16 172.96 11.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.195 -0.941 . . . . 0.0 110.032 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -120.03 135.44 54.93 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.262 -0.898 . . . . 0.0 110.594 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.669 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.2 mp -95.43 165.38 12.39 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.166 -0.959 . . . . 0.0 109.442 179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.526 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.2 t -99.48 -22.16 15.62 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.063 -1.023 . . . . 0.0 112.031 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.775 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.1 m-70 -117.17 145.95 43.51 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.721 -1.237 . . . . 0.0 110.282 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -127.81 92.85 3.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.241 -0.912 . . . . 0.0 109.569 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.455 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.81 178.93 1.28 Allowed Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.325 -0.86 . . . . 0.0 110.116 -179.529 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -70.53 -26.71 23.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.377 1.198 . . . . 0.0 111.108 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 m -92.66 -41.73 10.02 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.81 -1.181 . . . . 0.0 109.929 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.775 HG11 ' HB2' ' A' ' 15' ' ' HIS . 67.5 t -60.97 -52.49 61.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.584 0 O-C-N 121.128 -0.983 . . . . 0.0 109.602 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.8 mtp-105 -56.4 -50.37 71.82 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.053 -1.029 . . . . 0.0 109.558 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -62.25 -41.28 98.3 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.359 -0.936 . . . . 0.0 108.573 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 57.9 m -54.25 -43.68 71.12 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.081 -1.012 . . . . 0.0 108.445 178.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.4 t60 -62.22 -38.68 90.11 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.407 -0.808 . . . . 0.0 108.832 177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -95.84 51.89 1.29 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.155 -0.966 . . . . 0.0 110.336 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.35 37.72 4.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.098 -1.001 . . . . 0.0 110.257 179.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.79 128.38 3.44 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 40.5 ttt-85 -53.83 -28.83 37.98 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.195 -1.179 . . . . 0.0 110.523 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 6.3 tppt? -59.84 -36.35 76.67 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.925 -1.109 . . . . 0.0 110.349 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.599 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -52.16 -40.23 61.13 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.967 -1.083 . . . . 0.0 110.371 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 ttpt -63.42 -55.05 27.42 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.181 -0.949 . . . . 0.0 109.069 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -60.25 -38.9 84.93 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.245 -0.909 . . . . 0.0 109.098 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -57.12 -38.84 74.02 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.156 -0.965 . . . . 0.0 109.849 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.924 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -60.15 -38.6 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.126 -0.984 . . . . 0.0 109.721 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -56.5 -49.24 75.3 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 120.988 -1.07 . . . . 0.0 109.445 179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -56.72 -27.58 59.45 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.317 -0.865 . . . . 0.0 110.49 178.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -74.38 -50.59 17.98 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 120.904 -1.122 . . . . 0.0 110.548 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.658 ' CE2' HG12 ' A' ' 34' ' ' VAL . 38.5 p90 -99.53 34.43 2.22 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.016 -1.052 . . . . 0.0 111.552 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.4 tp60 -83.85 -40.47 18.62 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 120.726 -1.234 . . . . 0.0 109.824 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.9 tttt -115.02 29.43 8.04 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.264 -0.898 . . . . 0.0 110.83 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CE2' ' HE2' ' A' ' 42' ' ' MET . 12.3 t90 -51.27 -53.68 33.22 Favored 'General case' 0 N--CA 1.513 2.718 0 O-C-N 120.946 -1.096 . . . . 0.0 110.873 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CE2' ' A' ' 41' ' ' TRP . 19.6 mtm -144.7 -71.1 0.28 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.0 110.448 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -172.64 45.94 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.299 0 O-C-N 120.928 -1.107 . . . . 0.0 111.126 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -165.31 -168.19 1.32 Allowed 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.124 -0.985 . . . . 0.0 110.939 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -115.47 126.63 54.55 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.208 -0.933 . . . . 0.0 110.074 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -116.34 74.74 0.92 Allowed 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.179 -0.951 . . . . 0.0 110.304 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -109.03 35.81 3.11 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.047 -1.033 . . . . 0.0 110.395 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -112.09 -53.56 2.7 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.148 -0.97 . . . . 0.0 109.843 179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -20.85 63.4 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.188 -0.945 . . . . 0.0 111.545 179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.924 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -69.51 -47.61 71.07 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.677 -1.265 . . . . 0.0 109.58 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.5 -38.53 77.85 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.121 -0.987 . . . . 0.0 110.245 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.2 tttt -70.87 -35.31 72.32 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.13 -0.981 . . . . 0.0 110.417 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m -83.8 -39.73 19.63 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.004 -1.06 . . . . 0.0 110.174 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.8 p -59.39 -39.0 81.97 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.132 -0.98 . . . . 0.0 110.155 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.35 -39.64 93.79 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.19 -0.944 . . . . 0.0 110.011 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.44 -38.11 65.92 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 121.058 -1.027 . . . . 0.0 110.605 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -55.55 -38.33 69.17 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.084 -1.01 . . . . 0.0 110.411 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 51.1 0.92 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.123 -0.985 . . . . 0.0 110.163 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 52.64 86.93 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.053 -1.029 . . . . 0.0 110.786 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -99.36 -49.11 1.6 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.0 tttm . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.22 -1.165 . . . . 0.0 110.188 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.8 ttm . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.96 149.6 47.36 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.419 1.221 . . . . 0.0 110.517 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.2 mttm -138.56 151.87 47.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.189 -0.945 . . . . 0.0 110.015 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE2' ' NH2' ' A' ' 21' ' ' ARG . 37.2 t80 -115.85 156.2 26.53 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.189 -0.944 . . . . 0.0 109.912 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -140.52 140.5 35.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.156 -0.965 . . . . 0.0 110.442 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.0 t -113.17 98.54 7.2 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.251 -0.905 . . . . 0.0 109.99 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -56.47 -36.55 69.21 Favored 'General case' 0 N--CA 1.512 2.653 0 O-C-N 121.204 -0.935 . . . . 0.0 110.693 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 24.6 m-85 -62.5 -34.5 76.98 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.047 -1.033 . . . . 0.0 110.064 179.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.9 m -93.41 -3.18 53.67 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.055 -1.028 . . . . 0.0 112.004 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.5 t0 53.98 38.73 29.48 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.4 -1.438 . . . . 0.0 110.457 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -134.66 171.68 14.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.265 -0.897 . . . . 0.0 109.86 179.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -124.09 120.54 32.67 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.261 -0.899 . . . . 0.0 110.309 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.2 mp -83.0 162.05 21.56 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.12 -0.987 . . . . 0.0 109.493 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.516 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -101.09 -31.04 11.26 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.086 -1.009 . . . . 0.0 111.848 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.516 ' CD2' HG23 ' A' ' 14' ' ' THR . 42.4 m-70 -115.23 137.6 51.85 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.796 -1.19 . . . . 0.0 110.427 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -116.27 89.41 3.1 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.252 -0.905 . . . . 0.0 109.765 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -131.63 -179.99 1.2 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.328 -0.857 . . . . 0.0 109.923 -179.568 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.33 -28.92 17.67 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.419 1.221 . . . . 0.0 111.093 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 t -92.27 -44.25 8.85 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.889 -1.132 . . . . 0.0 110.019 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.486 HG11 ' HB2' ' A' ' 15' ' ' HIS . 98.0 t -59.03 -52.23 63.16 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.636 0 O-C-N 121.052 -1.03 . . . . 0.0 109.825 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.449 ' NH2' ' CE2' ' A' ' 4' ' ' PHE . 24.9 mtp85 -58.49 -50.25 74.43 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.031 -1.043 . . . . 0.0 109.552 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -61.27 -39.9 92.12 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.186 -0.946 . . . . 0.0 108.881 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.5 m -54.03 -42.23 68.92 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 121.149 -0.969 . . . . 0.0 108.681 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.61 -39.58 94.74 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 178.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.2 t -93.9 57.3 2.44 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.304 -0.873 . . . . 0.0 110.084 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.5 m -113.06 37.87 3.01 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.104 -0.998 . . . . 0.0 110.557 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.28 126.55 1.99 Allowed Glycine 0 N--CA 1.494 2.512 0 N-CA-C 110.096 -1.201 . . . . 0.0 110.096 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -55.08 -28.19 50.54 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.058 -1.26 . . . . 0.0 110.165 178.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -57.8 -33.9 69.06 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.888 -1.133 . . . . 0.0 110.394 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 19.4 t-80 -49.45 -43.94 45.24 Favored 'General case' 0 N--CA 1.515 2.812 0 O-C-N 120.991 -1.068 . . . . 0.0 110.86 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 23.9 tttt -60.79 -54.08 49.55 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.061 -1.024 . . . . 0.0 109.185 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -60.03 -38.44 82.73 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.211 -0.931 . . . . 0.0 109.088 178.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -56.51 -37.17 70.06 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.173 -0.954 . . . . 0.0 110.198 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 84.0 t -61.91 -37.34 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 121.082 -1.011 . . . . 0.0 110.066 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 4.3 mtpt -54.24 -41.78 69.14 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 120.901 -1.124 . . . . 0.0 109.73 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -58.91 -28.89 66.62 Favored 'General case' 0 N--CA 1.506 2.335 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.291 178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -71.18 -52.16 20.75 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.924 -1.11 . . . . 0.0 110.285 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.52 ' CD1' ' HB3' ' A' ' 46' ' ' ALA . 37.9 p90 -100.09 35.8 1.99 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.079 -1.013 . . . . 0.0 111.263 179.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -37.9 14.28 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 120.85 -1.156 . . . . 0.0 110.151 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 tttt -112.87 27.82 9.31 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 111.165 179.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.426 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.0 t90 -70.18 -43.08 71.51 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.029 -1.045 . . . . 0.0 110.019 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.426 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -151.66 36.32 0.57 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.219 -0.926 . . . . 0.0 110.746 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 50.54 38.77 19.47 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.961 -1.087 . . . . 0.0 111.088 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -140.84 -173.94 3.85 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.139 -0.976 . . . . 0.0 110.304 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -112.77 116.69 30.48 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.124 -0.985 . . . . 0.0 109.888 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.52 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -115.77 73.47 0.84 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.201 -0.937 . . . . 0.0 110.221 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.74 36.76 2.32 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.082 -1.011 . . . . 0.0 110.205 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.8 p -113.08 -55.63 2.5 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.118 -0.989 . . . . 0.0 109.452 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.44 -21.65 64.33 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.183 -0.948 . . . . 0.0 111.161 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.741 HD12 HG11 ' A' ' 34' ' ' VAL . 44.3 mm -66.79 -41.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 120.618 -1.301 . . . . 0.0 109.219 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.458 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 1.4 t70 -61.17 -41.73 97.3 Favored 'General case' 0 N--CA 1.508 2.473 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.606 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.2 tttm -59.97 -36.49 77.22 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.189 -0.944 . . . . 0.0 110.14 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.45 ' CG2' ' CE1' ' A' ' 57' ' ' PHE . 46.5 m -84.71 -40.36 17.43 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.041 -1.037 . . . . 0.0 109.998 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.458 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 38.2 p -68.36 -39.6 81.77 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.108 -0.995 . . . . 0.0 109.789 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.66 -35.55 68.53 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 110.434 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.89 -36.19 15.19 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.995 -1.066 . . . . 0.0 110.336 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE1' ' CG2' ' A' ' 53' ' ' THR . 2.4 m-85 -49.93 -35.23 23.16 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.061 -1.024 . . . . 0.0 111.038 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -109.41 -52.77 2.73 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.118 -0.989 . . . . 0.0 110.376 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -115.33 67.51 0.7 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.12 -0.988 . . . . 0.0 110.242 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.76 66.78 0.26 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.2 mttm . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.203 -1.175 . . . . 0.0 110.237 -179.99 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.403 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.215 0 CA-C-O 119.81 -0.138 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 1' ' ' MET . 49.7 Cg_endo -79.08 168.39 20.6 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 123.097 1.051 . . . . 0.0 110.288 -179.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.8 mttm 61.69 125.84 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.176 -0.953 . . . . 0.0 110.531 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.495 ' HD2' HD13 ' A' ' 13' ' ' LEU . 58.0 t80 -103.83 161.18 14.17 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 120.948 -1.095 . . . . 0.0 110.192 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 93.4 t80 -133.39 137.27 45.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.167 -0.958 . . . . 0.0 110.435 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.6 t -113.69 98.96 7.36 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.303 -0.873 . . . . 0.0 110.077 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.3 p-10 -56.48 -36.83 69.55 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.105 -0.997 . . . . 0.0 110.256 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.607 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.8 m-85 -59.7 -33.42 71.58 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.402 ' CB ' HG22 ' A' ' 11' ' ' THR . 39.1 m -95.56 0.15 52.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.016 -1.052 . . . . 0.0 112.112 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 t70 51.92 37.78 21.84 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.398 -1.439 . . . . 0.0 110.741 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.402 HG22 ' CB ' ' A' ' 9' ' ' CYS . 8.3 t -144.24 171.75 13.87 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.233 -0.917 . . . . 0.0 109.892 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.38 125.27 47.57 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 110.206 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.495 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.3 mp -74.7 170.29 16.13 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.155 -0.966 . . . . 0.0 109.704 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.509 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.0 t -100.3 -31.8 11.17 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.217 -0.927 . . . . 0.0 111.681 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.509 ' CD2' HG23 ' A' ' 14' ' ' THR . 37.1 m-70 -116.54 142.21 47.17 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.83 -1.169 . . . . 0.0 110.386 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -117.79 93.69 4.24 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.166 -0.959 . . . . 0.0 109.857 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.441 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.05 177.94 1.9 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.273 -0.892 . . . . 0.0 110.12 -179.757 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.96 -31.11 15.69 Favored 'Trans proline' 0 C--N 1.316 -1.151 0 O-C-N 123.426 1.224 . . . . 0.0 110.954 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.52 -41.77 11.21 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.021 -1.049 . . . . 0.0 110.002 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.494 HG11 ' HB2' ' A' ' 15' ' ' HIS . 97.2 t -59.31 -54.29 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.604 0 O-C-N 121.114 -0.991 . . . . 0.0 109.911 179.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.422 ' HG2' ' CD2' ' A' ' 4' ' ' PHE . 14.8 mtp-105 -56.56 -49.87 73.58 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.102 -0.999 . . . . 0.0 109.907 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -40.47 97.65 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.163 -1.015 . . . . 0.0 108.794 178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 55.8 m -54.74 -42.68 71.9 Favored 'General case' 0 N--CA 1.511 2.622 0 O-C-N 121.08 -1.013 . . . . 0.0 108.423 178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.6 t60 -62.36 -35.76 80.12 Favored 'General case' 0 N--CA 1.503 2.185 0 C-N-CA 119.643 -0.823 . . . . 0.0 109.256 178.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.3 t -100.62 42.8 1.09 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.096 -1.003 . . . . 0.0 110.479 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -115.34 38.42 3.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.203 -0.936 . . . . 0.0 110.213 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -142.75 128.37 3.45 Favored Glycine 0 N--CA 1.489 2.227 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -54.11 -28.7 41.29 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.227 -1.161 . . . . 0.0 110.359 179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.0 tttp -59.24 -35.38 73.56 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.973 -1.079 . . . . 0.0 110.397 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.558 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.6 t-80 -51.83 -39.04 58.15 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 120.91 -1.119 . . . . 0.0 110.473 -179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -62.19 -53.7 51.55 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.092 -1.005 . . . . 0.0 109.037 179.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -60.63 -39.22 87.42 Favored 'General case' 0 N--CA 1.507 2.424 0 C-N-CA 119.372 -0.931 . . . . 0.0 109.037 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -56.26 -38.74 71.55 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.131 -0.981 . . . . 0.0 109.915 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.806 HG11 HD12 ' A' ' 50' ' ' ILE . 79.0 t -58.89 -38.95 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.55 0 O-C-N 121.042 -1.036 . . . . 0.0 109.597 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 1.2 tmmt? -54.47 -39.97 67.98 Favored 'General case' 0 N--CA 1.513 2.705 0 O-C-N 121.028 -1.045 . . . . 0.0 109.618 179.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -58.75 -33.14 69.94 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 178.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.9 t80 -64.37 -53.65 45.25 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.033 -1.042 . . . . 0.0 109.621 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.564 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.9 p90 -100.73 35.29 2.2 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.203 -0.936 . . . . 0.0 110.922 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -77.45 -35.91 53.48 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.753 -1.217 . . . . 0.0 110.293 179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.2 mttm -102.27 21.21 15.39 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.063 -1.023 . . . . 0.0 111.402 179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.466 ' CZ2' ' HE1' ' A' ' 42' ' ' MET . 8.2 t90 -106.93 -52.8 2.71 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.88 -1.138 . . . . 0.0 109.827 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.669 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 2.7 mtm -142.03 54.46 1.47 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.28 -0.888 . . . . 0.0 109.817 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -50.27 -34.99 25.25 Favored 'General case' 0 N--CA 1.514 2.731 0 O-C-N 121.121 -0.987 . . . . 0.0 111.272 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -52.2 -61.96 1.94 Allowed 'General case' 0 N--CA 1.513 2.705 0 O-C-N 120.937 -1.102 . . . . 0.0 110.585 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -147.75 96.62 2.7 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.423 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.669 ' HB2' ' HB3' ' A' ' 42' ' ' MET . . . -145.79 71.51 1.27 Allowed 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.229 -0.919 . . . . 0.0 110.486 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.14 35.15 2.33 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.15 -0.969 . . . . 0.0 110.482 179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -109.02 -52.88 2.71 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.061 -1.024 . . . . 0.0 109.578 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.76 -20.93 64.1 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.262 -0.898 . . . . 0.0 111.334 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.806 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -75.13 -39.99 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 O-C-N 120.622 -1.299 . . . . 0.0 109.847 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.442 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 1.4 m-20 -75.76 -40.38 55.47 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.095 -1.003 . . . . 0.0 110.004 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.82 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 30.4 mtpt -57.42 -34.74 69.24 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.164 -0.96 . . . . 0.0 110.635 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.7 m -90.45 -38.66 13.11 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.021 -1.05 . . . . 0.0 110.247 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 50' ' ' ILE . 62.8 p -71.68 -34.79 69.99 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.077 -1.014 . . . . 0.0 110.401 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.93 -39.65 12.15 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.998 -1.064 . . . . 0.0 110.263 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.82 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.73 51.83 1.3 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.136 -0.978 . . . . 0.0 110.499 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -92.91 -59.49 2.04 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.13 -0.981 . . . . 0.0 110.093 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -149.05 51.63 0.97 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.198 -0.939 . . . . 0.0 110.484 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -119.4 -57.78 1.97 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.172 -0.955 . . . . 0.0 110.309 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -142.94 -61.07 0.02 OUTLIER Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.1 tttm . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.201 -1.176 . . . . 0.0 110.228 -179.95 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 mtm . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.71 115.93 4.53 Favored 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.442 1.233 . . . . 0.0 110.382 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.454 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 42.8 mttt -127.55 152.31 47.78 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.216 -0.927 . . . . 0.0 110.275 -179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.645 ' HD1' HD13 ' A' ' 13' ' ' LEU . 90.2 t80 -109.65 161.98 14.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.153 -0.967 . . . . 0.0 110.167 -179.774 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -129.36 138.24 51.42 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.113 -0.992 . . . . 0.0 110.37 -179.873 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 47.4 t -117.11 96.77 5.59 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.17 -0.956 . . . . 0.0 109.967 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -51.88 -35.98 47.03 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.021 -1.05 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.708 ' CD1' HG13 ' A' ' 34' ' ' VAL . 76.9 m-85 -62.81 -31.19 72.13 Favored 'General case' 0 N--CA 1.51 2.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.186 179.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.449 ' HB3' HG22 ' A' ' 11' ' ' THR . 36.0 m -98.02 -9.45 26.02 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.008 -1.058 . . . . 0.0 111.965 179.786 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.1 t70 56.34 41.22 29.33 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.382 -1.449 . . . . 0.0 110.014 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.449 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.9 t -146.21 174.26 11.49 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.281 -0.887 . . . . 0.0 110.191 -179.942 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.454 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 4.7 t80 -117.68 138.84 51.73 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.3 -0.875 . . . . 0.0 110.623 -179.686 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 4' ' ' PHE . 5.4 mp -93.79 171.31 8.95 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.137 -0.977 . . . . 0.0 109.735 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.8 t -96.67 -30.2 13.38 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.26 -0.9 . . . . 0.0 111.368 -179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.719 ' HB2' HG11 ' A' ' 20' ' ' VAL . 49.6 m-70 -113.21 148.26 35.84 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.823 -1.173 . . . . 0.0 110.188 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -126.65 96.3 4.62 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.255 -0.903 . . . . 0.0 109.845 -179.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.452 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -152.23 178.1 1.68 Allowed Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.234 -0.916 . . . . 0.0 110.456 -179.712 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.0 Cg_endo -70.72 -33.64 12.63 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.296 1.156 . . . . 0.0 110.74 179.805 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.7 m -84.65 -37.09 21.47 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.007 -1.058 . . . . 0.0 110.142 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.719 HG11 ' HB2' ' A' ' 15' ' ' HIS . 59.9 t -64.51 -45.81 94.56 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 O-C-N 121.084 -1.01 . . . . 0.0 109.438 179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -57.27 -50.77 71.84 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 120.992 -1.067 . . . . 0.0 109.571 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 tmtt? -61.65 -41.4 97.46 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.345 -0.942 . . . . 0.0 108.69 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.4 m -54.6 -43.43 72.15 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.18 -0.95 . . . . 0.0 108.612 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.435 ' ND1' HD21 ' A' ' 13' ' ' LEU . 75.4 t60 -61.13 -37.61 83.41 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.452 -0.78 . . . . 0.0 109.109 178.081 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.5 t -94.21 54.65 1.91 Allowed 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.119 -0.988 . . . . 0.0 110.386 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.12 38.98 3.67 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.087 -1.008 . . . . 0.0 110.049 179.656 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -130.59 163.43 23.25 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.758 -1.337 . . . . 0.0 109.758 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -88.96 -12.49 41.42 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.323 -1.104 . . . . 0.0 110.901 178.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.1 mmtm -91.11 -26.64 19.03 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.634 -1.291 . . . . 0.0 111.177 179.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.549 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.3 t-80 -49.37 -38.66 29.3 Favored 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.836 -1.165 . . . . 0.0 110.751 -179.695 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -64.83 -53.44 46.77 Favored 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 119.216 -0.994 . . . . 0.0 108.981 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -61.09 -39.5 90.17 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.181 -0.949 . . . . 0.0 109.028 178.553 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -56.27 -37.98 70.56 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.137 -0.977 . . . . 0.0 110.055 179.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.708 HG13 ' CD1' ' A' ' 8' ' ' TYR . 64.4 t -59.74 -38.28 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.51 0 O-C-N 121.113 -0.992 . . . . 0.0 109.84 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 17.6 mttm -55.11 -40.69 70.75 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 120.912 -1.118 . . . . 0.0 109.782 179.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -58.36 -32.14 68.28 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.303 -0.873 . . . . 0.0 110.133 179.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -65.31 -52.84 51.44 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 120.965 -1.085 . . . . 0.0 110.116 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.599 ' HE2' HG12 ' A' ' 34' ' ' VAL . 47.9 p90 -100.55 35.5 2.12 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.082 -1.011 . . . . 0.0 111.061 179.611 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -81.63 -37.73 27.08 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 120.727 -1.233 . . . . 0.0 110.297 179.205 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -112.73 21.42 15.57 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.207 -0.933 . . . . 0.0 111.587 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.452 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 17.8 t90 -61.08 -46.49 90.45 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 120.809 -1.182 . . . . 0.0 109.858 -179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.452 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.6 mtm -152.65 36.24 0.5 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.211 -0.93 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 50.65 46.47 25.67 Favored 'General case' 0 N--CA 1.502 2.125 0 O-C-N 120.939 -1.101 . . . . 0.0 111.055 179.769 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -146.33 -172.3 3.92 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.107 -0.996 . . . . 0.0 110.374 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -110.86 162.95 14.29 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.155 -0.966 . . . . 0.0 109.999 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.497 ' HB3' ' CD1' ' A' ' 38' ' ' TYR . . . -168.75 77.57 0.12 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 121.167 -0.958 . . . . 0.0 111.164 -179.748 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -109.85 34.5 3.81 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.058 -1.026 . . . . 0.0 110.433 179.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -118.03 -57.71 2.07 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.182 -0.949 . . . . 0.0 109.101 179.251 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 pp -54.33 -26.34 29.1 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.195 -0.941 . . . . 0.0 111.271 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.638 HD12 HG11 ' A' ' 34' ' ' VAL . 41.5 mm -61.15 -41.51 89.71 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 120.646 -1.284 . . . . 0.0 109.483 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.23 -36.29 79.53 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.229 -0.919 . . . . 0.0 110.753 -179.62 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.51 -39.61 11.84 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.059 -1.026 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -61.99 -39.75 93.27 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.154 -0.966 . . . . 0.0 110.091 -179.878 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.614 HG23 ' O ' ' A' ' 50' ' ' ILE . 30.8 p -57.18 -38.18 73.22 Favored 'General case' 0 N--CA 1.511 2.602 0 O-C-N 121.131 -0.98 . . . . 0.0 110.48 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.03 -40.08 11.28 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.141 -0.974 . . . . 0.0 110.153 179.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.84 54.56 1.75 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.116 -0.99 . . . . 0.0 110.337 179.736 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -93.05 -39.42 11.09 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.13 -0.981 . . . . 0.0 110.28 179.723 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -114.47 66.59 0.68 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.111 -0.993 . . . . 0.0 110.153 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -134.28 -59.2 0.83 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -131.76 64.82 0.6 Allowed Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.2 mttm . . . . . 0 N--CA 1.502 2.159 0 O-C-N 121.125 -1.221 . . . . 0.0 110.778 -179.991 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 mtp . . . . . 0 N--CA 1.492 1.662 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -73.07 112.44 3.52 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.44 1.232 . . . . 0.0 110.47 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.445 ' HE3' ' OG1' ' A' ' 14' ' ' THR . 23.8 mttp -146.61 154.2 41.22 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.24 -0.913 . . . . 0.0 110.413 -179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.445 ' CD1' ' NH1' ' A' ' 21' ' ' ARG . 43.1 t80 -110.21 156.04 21.19 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.202 -0.936 . . . . 0.0 109.886 179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -138.38 136.8 36.67 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.608 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.1 t -110.6 93.45 4.5 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.2 -0.938 . . . . 0.0 110.089 179.473 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -52.23 -36.23 51.82 Favored 'General case' 0 N--CA 1.513 2.703 0 O-C-N 121.072 -1.017 . . . . 0.0 110.515 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.863 ' CD1' HG13 ' A' ' 34' ' ' VAL . 87.5 m-85 -60.34 -32.58 71.39 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.133 -0.98 . . . . 0.0 110.025 178.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.1 m -97.45 -0.52 46.0 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.057 -1.027 . . . . 0.0 112.162 -179.988 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.5 t70 52.73 38.93 27.62 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.383 -1.448 . . . . 0.0 110.599 -179.709 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -137.56 172.76 12.49 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.286 -0.884 . . . . 0.0 110.021 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.0 120.17 32.57 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.31 -0.869 . . . . 0.0 110.131 -179.759 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -82.17 146.34 29.61 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.193 -0.942 . . . . 0.0 109.612 179.472 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.445 ' OG1' ' HE3' ' A' ' 3' ' ' LYS . 14.1 t -104.06 -20.55 13.81 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.073 -1.017 . . . . 0.0 112.62 -179.35 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.532 ' HB2' HG11 ' A' ' 20' ' ' VAL . 27.7 m-70 -106.16 70.44 0.84 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.587 -1.32 . . . . 0.0 110.301 -179.849 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.7 p-10 -61.11 101.78 0.17 Allowed 'General case' 0 N--CA 1.507 2.393 0 O-C-N 121.197 -0.939 . . . . 0.0 109.874 179.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -148.22 176.63 2.12 Favored Pre-proline 0 N--CA 1.497 1.901 0 O-C-N 121.022 -1.049 . . . . 0.0 110.314 -179.727 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.83 -31.86 15.07 Favored 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.519 1.273 . . . . 0.0 110.89 179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.5 m -91.1 -39.78 11.97 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.953 -1.092 . . . . 0.0 110.222 179.605 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.0 t -60.01 -49.18 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.568 0 O-C-N 121.155 -0.966 . . . . 0.0 109.663 179.761 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.445 ' NH1' ' CD1' ' A' ' 4' ' ' PHE . 16.5 mtp180 -58.56 -51.73 68.64 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.079 -1.013 . . . . 0.0 109.609 179.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.68 -40.6 97.6 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.262 -0.975 . . . . 0.0 108.818 179.014 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 93.8 m -56.0 -42.88 77.08 Favored 'General case' 0 N--CA 1.511 2.619 0 O-C-N 121.077 -1.014 . . . . 0.0 108.37 178.316 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -63.53 -36.38 83.59 Favored 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 119.605 -0.838 . . . . 0.0 109.152 178.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 t -100.16 43.85 1.04 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.138 -0.976 . . . . 0.0 110.473 -179.671 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.77 38.49 3.29 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.182 -0.949 . . . . 0.0 110.138 179.773 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.95 127.32 2.97 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -54.63 -28.33 46.07 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 121.087 -1.243 . . . . 0.0 110.226 178.955 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -58.92 -33.63 70.79 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 120.991 -1.068 . . . . 0.0 110.681 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.606 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.0 t-80 -50.84 -38.44 49.01 Favored 'General case' 0 N--CA 1.516 2.828 0 O-C-N 120.876 -1.14 . . . . 0.0 110.705 -179.41 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -63.65 -53.03 57.83 Favored 'General case' 0 N--CA 1.507 2.401 0 O-C-N 121.135 -0.978 . . . . 0.0 108.942 179.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -60.98 -39.89 91.33 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.239 -0.913 . . . . 0.0 108.944 178.642 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -56.11 -38.12 70.34 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.211 -0.931 . . . . 0.0 110.083 179.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.863 HG13 ' CD1' ' A' ' 8' ' ' TYR . 79.3 t -57.58 -36.8 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.601 0 O-C-N 121.069 -1.019 . . . . 0.0 110.032 179.626 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.9 tttt -53.02 -40.96 64.24 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.924 -1.11 . . . . 0.0 109.892 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -58.79 -29.67 67.0 Favored 'General case' 0 N--CA 1.507 2.39 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.223 178.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -68.55 -52.4 32.28 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.976 -1.078 . . . . 0.0 110.257 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.457 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 43.4 p90 -100.09 33.58 2.58 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 121.004 -1.06 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -87.46 -64.71 1.11 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.791 -1.193 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' CG ' ' A' ' 43' ' ' GLU . 1.3 tptm -64.42 -34.64 78.65 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.304 -0.873 . . . . 0.0 110.086 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 8.5 t90 -52.52 -48.07 66.28 Favored 'General case' 0 N--CA 1.511 2.605 0 O-C-N 121.041 -1.037 . . . . 0.0 111.278 -179.453 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.461 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -105.82 -45.22 4.44 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.02 -1.05 . . . . 0.0 111.26 -179.308 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.406 ' CG ' ' HA ' ' A' ' 40' ' ' LYS . 40.1 mm-40 53.4 37.63 25.97 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.974 -1.079 . . . . 0.0 110.704 -179.504 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -160.75 -66.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.222 -0.924 . . . . 0.0 110.83 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -158.54 104.87 1.82 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.264 -0.897 . . . . 0.0 110.809 -179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.408 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -145.79 70.67 1.25 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.24 -0.912 . . . . 0.0 110.326 -179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -120.46 36.76 4.46 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.373 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.7 -53.71 2.67 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.195 -0.941 . . . . 0.0 109.654 179.491 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.35 -21.05 63.66 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.196 -0.94 . . . . 0.0 111.464 179.537 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 48.5 mm -72.61 -40.1 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 120.626 -1.296 . . . . 0.0 109.777 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 7.1 m-20 -65.67 -40.15 92.11 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.124 -0.985 . . . . 0.0 109.971 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 14.2 mttt -64.18 -35.2 80.02 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.136 -0.977 . . . . 0.0 110.502 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.7 m -87.64 -40.42 14.2 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.008 -1.057 . . . . 0.0 110.131 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 50' ' ' ILE . 18.8 p -59.11 -36.41 75.12 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.158 -0.964 . . . . 0.0 110.289 179.767 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.81 -43.93 9.74 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.062 -1.023 . . . . 0.0 110.003 179.738 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -93.75 58.64 2.7 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 179.561 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -92.59 11.61 25.95 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.241 -0.912 . . . . 0.0 112.098 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 54.63 93.45 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.433 -1.417 . . . . 0.0 110.433 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -87.72 -39.57 14.85 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.335 -0.853 . . . . 0.0 110.115 179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -106.82 -110.35 3.47 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.894 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt . . . . . 0 N--CA 1.499 2.013 0 O-C-N 121.164 -1.198 . . . . 0.0 110.766 -179.979 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 40.7 mtt . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.52 101.55 1.28 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.39 1.205 . . . . 0.0 110.349 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.7 mtmm -120.28 146.35 46.18 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.177 -0.952 . . . . 0.0 110.276 -179.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.519 ' CD2' HD13 ' A' ' 13' ' ' LEU . 42.3 t80 -114.75 156.43 24.84 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.157 -0.965 . . . . 0.0 109.921 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -136.08 135.94 39.77 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.104 -0.997 . . . . 0.0 110.561 -179.733 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 37.2 t -111.63 93.82 4.66 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.224 -0.922 . . . . 0.0 110.202 179.461 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -52.64 -35.85 55.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 121.115 -0.991 . . . . 0.0 110.379 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.851 ' CD1' HG13 ' A' ' 34' ' ' VAL . 79.7 m-85 -60.86 -32.85 72.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.176 -0.952 . . . . 0.0 110.098 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.3 m -96.95 -0.71 47.08 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 120.991 -1.068 . . . . 0.0 112.084 179.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t70 53.07 38.64 27.88 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.367 -1.458 . . . . 0.0 110.656 -179.737 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -139.43 171.68 13.91 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.147 -0.971 . . . . 0.0 110.036 179.836 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -122.17 120.39 34.08 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.184 -0.947 . . . . 0.0 110.032 -179.66 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.519 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.6 mp -78.25 166.14 23.06 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.161 -0.962 . . . . 0.0 109.558 179.43 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.492 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -102.22 -30.43 11.11 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.085 -1.009 . . . . 0.0 112.013 -179.367 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.492 ' CD2' HG23 ' A' ' 14' ' ' THR . 45.5 m-70 -113.72 139.78 48.8 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.682 -1.261 . . . . 0.0 110.5 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -116.13 94.98 4.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.359 -0.838 . . . . 0.0 109.765 179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -143.24 176.53 2.25 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.234 -0.916 . . . . 0.0 110.169 -179.665 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -69.49 -30.33 23.71 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 O-C-N 123.386 1.203 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.5 t -88.01 -41.47 13.09 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.931 -1.105 . . . . 0.0 109.974 179.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.3 t -59.82 -50.47 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.531 0 O-C-N 121.187 -0.946 . . . . 0.0 109.787 179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' NH1' ' CE1' ' A' ' 4' ' ' PHE . 19.4 mtt180 -58.06 -51.73 68.46 Favored 'General case' 0 N--CA 1.51 2.575 0 O-C-N 121.053 -1.029 . . . . 0.0 109.611 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.2 mttp -60.85 -40.58 93.43 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.305 -0.958 . . . . 0.0 108.958 178.848 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.0 m -55.36 -43.04 74.7 Favored 'General case' 0 N--CA 1.512 2.636 0 O-C-N 121.145 -0.972 . . . . 0.0 108.507 178.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -64.37 -39.71 94.4 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.425 -0.797 . . . . 0.0 108.95 178.148 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.17 56.53 2.54 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.145 -0.972 . . . . 0.0 110.274 -179.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -116.27 37.86 3.57 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.049 -1.032 . . . . 0.0 110.403 179.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.49 125.2 2.01 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.917 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.5 ttm105 -54.71 -27.96 44.5 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.174 -1.192 . . . . 0.0 110.359 179.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 tptt -60.62 -31.78 70.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 120.933 -1.104 . . . . 0.0 110.764 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.597 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.2 t-80 -49.83 -42.59 47.61 Favored 'General case' 0 N--CA 1.517 2.892 0 O-C-N 120.884 -1.135 . . . . 0.0 110.865 -179.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.9 tttt -62.7 -52.56 62.81 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.116 -0.99 . . . . 0.0 109.109 179.22 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -61.4 -40.23 93.62 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.194 -0.941 . . . . 0.0 108.894 178.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 65.9 m-20 -56.27 -37.94 70.5 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.324 -0.86 . . . . 0.0 109.914 179.083 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.851 HG13 ' CD1' ' A' ' 8' ' ' TYR . 78.2 t -55.95 -34.52 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.602 0 O-C-N 121.05 -1.031 . . . . 0.0 110.141 179.632 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.462 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 33.8 tttt -54.82 -42.92 72.47 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.858 -1.151 . . . . 0.0 109.763 179.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.39 -27.97 64.76 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 178.904 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -70.03 -52.08 26.98 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.891 -1.131 . . . . 0.0 110.325 -179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.466 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 40.6 p90 -99.69 32.53 2.82 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.991 -1.068 . . . . 0.0 111.404 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -82.49 -38.46 23.85 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.728 -1.233 . . . . 0.0 109.805 178.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.5 tttp -109.28 31.35 5.81 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.234 -0.916 . . . . 0.0 110.548 179.261 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 7.8 t90 -85.84 -40.49 15.92 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.062 -1.024 . . . . 0.0 110.134 -179.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.544 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 14.8 ptp -176.59 -43.69 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.139 -0.976 . . . . 0.0 112.038 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -116.62 176.8 4.95 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.677 -1.264 . . . . 0.0 110.452 -179.697 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -101.12 -42.72 6.26 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.277 -0.89 . . . . 0.0 110.594 -179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 38.7 tp60 -105.04 83.49 1.99 Allowed 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.039 -1.038 . . . . 0.0 110.198 179.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.466 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -117.13 75.16 0.96 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.204 -0.935 . . . . 0.0 110.107 -179.99 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.44 35.63 3.11 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.165 -0.959 . . . . 0.0 110.461 179.598 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -110.29 -54.31 2.59 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.126 -0.984 . . . . 0.0 109.401 179.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.82 -20.96 64.21 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.203 -0.936 . . . . 0.0 111.297 179.18 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.418 HD12 ' CG1' ' A' ' 34' ' ' VAL . 47.6 mm -71.81 -46.32 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.429 0 O-C-N 120.646 -1.284 . . . . 0.0 109.446 179.615 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.431 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 14.9 t70 -60.56 -38.47 84.65 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.236 -0.915 . . . . 0.0 110.028 179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.848 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -55.38 -35.06 64.89 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.045 -1.034 . . . . 0.0 110.659 -179.855 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m -91.47 -38.7 12.39 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.041 -1.037 . . . . 0.0 110.303 179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 82.7 p -74.64 -34.52 62.77 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.071 -1.018 . . . . 0.0 110.461 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.99 -38.17 13.82 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.972 -1.08 . . . . 0.0 110.178 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.848 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.15 46.14 1.04 Allowed 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.002 -1.061 . . . . 0.0 110.665 179.549 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.63 -59.05 2.16 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.153 -0.967 . . . . 0.0 110.134 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -146.8 71.47 1.23 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.192 -0.943 . . . . 0.0 110.486 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -145.43 82.31 1.64 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.087 -1.008 . . . . 0.0 110.338 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -87.11 -99.7 0.84 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.451 -1.459 . . . . 0.0 109.451 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.0 tptm . . . . . 0 N--CA 1.493 1.705 0 O-C-N 121.158 -1.201 . . . . 0.0 110.203 179.987 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.79 140.85 32.8 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.449 1.236 . . . . 0.0 110.408 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.434 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 25.4 mttt -129.55 154.25 47.22 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.227 -0.921 . . . . 0.0 110.22 -179.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.624 ' HD1' HD13 ' A' ' 13' ' ' LEU . 69.8 t80 -112.78 162.01 16.25 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.199 -0.938 . . . . 0.0 110.095 -179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -131.08 136.74 48.68 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.169 -0.957 . . . . 0.0 110.466 -179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.3 t -116.16 98.37 6.58 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.264 -0.898 . . . . 0.0 109.826 179.461 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -51.82 -35.92 46.05 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.015 -1.053 . . . . 0.0 110.782 -179.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.567 ' CD2' HG13 ' A' ' 34' ' ' VAL . 78.9 m-85 -63.65 -32.49 73.99 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.088 -1.008 . . . . 0.0 110.291 179.4 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 57.0 m -97.29 -10.49 25.6 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.097 -1.002 . . . . 0.0 111.881 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.3 t70 55.91 40.78 30.48 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.462 -1.399 . . . . 0.0 110.172 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.2 t -142.11 170.72 15.19 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.22 -0.925 . . . . 0.0 109.984 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 4.7 t80 -117.17 125.21 50.84 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.265 -0.897 . . . . 0.0 110.398 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.624 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.3 mp -80.61 170.68 16.02 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.203 -0.936 . . . . 0.0 109.72 179.67 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.521 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.1 t -96.91 -30.49 13.09 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.204 -0.935 . . . . 0.0 111.334 -179.793 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 47.5 m-70 -113.69 146.44 39.82 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.875 -1.141 . . . . 0.0 110.205 -179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -125.95 93.52 3.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.123 -0.985 . . . . 0.0 109.727 179.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -146.73 179.75 1.11 Allowed Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.216 -0.927 . . . . 0.0 110.222 -179.511 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.8 Cg_endo -71.75 -32.12 12.1 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.341 1.18 . . . . 0.0 110.935 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -86.06 -39.21 17.03 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 120.949 -1.094 . . . . 0.0 109.95 179.476 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 61.3 t -64.61 -47.48 88.81 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.461 0 O-C-N 121.12 -0.987 . . . . 0.0 109.609 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 23.9 mtt180 -57.62 -52.58 64.82 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 121.038 -1.039 . . . . 0.0 109.714 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -60.03 -39.84 87.28 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.128 -0.982 . . . . 0.0 108.943 178.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.3 m -55.08 -43.78 74.26 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.051 -1.031 . . . . 0.0 108.4 178.267 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.407 ' ND1' HD21 ' A' ' 13' ' ' LEU . 71.2 t60 -62.25 -37.46 85.53 Favored 'General case' 0 N--CA 1.504 2.252 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 177.84 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.34 48.46 0.99 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.216 -0.927 . . . . 0.0 110.271 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.05 38.27 3.23 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.087 -1.008 . . . . 0.0 110.245 179.805 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.89 127.66 2.86 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.9 ttp180 -54.21 -28.52 41.52 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.106 -1.232 . . . . 0.0 110.32 179.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.5 ttmt -58.68 -35.5 72.7 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.058 -1.026 . . . . 0.0 110.462 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.577 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.0 t-80 -51.74 -40.7 60.7 Favored 'General case' 0 N--CA 1.515 2.788 0 O-C-N 121.03 -1.044 . . . . 0.0 110.427 -179.709 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -63.06 -52.22 63.61 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.123 -0.986 . . . . 0.0 108.819 179.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -61.65 -39.92 93.06 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.185 -0.947 . . . . 0.0 108.868 178.507 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -56.21 -38.58 71.22 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.248 -0.907 . . . . 0.0 109.961 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.666 HG12 ' HE2' ' A' ' 38' ' ' TYR . 70.6 t -58.56 -38.89 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.125 -0.984 . . . . 0.0 109.712 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.6 mtmp? -57.29 -44.83 84.37 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.059 -1.025 . . . . 0.0 109.261 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.7 -31.81 64.85 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.339 -0.851 . . . . 0.0 110.051 178.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -64.07 -53.16 54.19 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.98 -1.075 . . . . 0.0 109.769 179.729 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.666 ' HE2' HG12 ' A' ' 34' ' ' VAL . 45.2 p90 -99.69 28.03 4.98 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.111 -0.993 . . . . 0.0 111.602 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -56.45 -41.0 75.74 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.637 -1.29 . . . . 0.0 110.064 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -126.94 28.42 5.81 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.248 -0.908 . . . . 0.0 111.199 179.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.464 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.1 t90 -52.59 -36.28 55.82 Favored 'General case' 0 N--CA 1.512 2.659 0 O-C-N 120.903 -1.123 . . . . 0.0 110.805 -179.72 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.464 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -138.35 -67.71 0.46 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.143 -0.973 . . . . 0.0 110.398 179.908 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -170.93 -52.01 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.092 -1.005 . . . . 0.0 111.138 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.08 -168.83 2.01 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.224 -0.922 . . . . 0.0 109.771 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.3 mm-40 -95.62 144.51 26.0 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.088 -1.008 . . . . 0.0 110.25 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.478 ' HB1' HD21 ' A' ' 49' ' ' LEU . . . -123.64 84.52 2.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.224 -0.923 . . . . 0.0 110.333 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -105.49 34.39 3.28 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.156 -0.965 . . . . 0.0 110.598 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 86.8 p -112.5 -55.04 2.56 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.112 -0.993 . . . . 0.0 109.314 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.478 HD21 ' HB1' ' A' ' 46' ' ' ALA . 0.6 OUTLIER -60.06 -21.62 61.66 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.3 -0.875 . . . . 0.0 111.403 179.225 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.507 HD12 HG11 ' A' ' 34' ' ' VAL . 46.4 mm -68.93 -48.38 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 120.58 -1.325 . . . . 0.0 109.395 179.604 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.457 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -58.99 -39.18 80.99 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.165 -0.96 . . . . 0.0 110.191 -179.912 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.3 mmmt -56.48 -36.61 69.31 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.211 -0.931 . . . . 0.0 110.72 -179.861 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 55.8 m -91.69 -46.92 7.65 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.096 -1.002 . . . . 0.0 110.406 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.457 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 48.1 p -57.84 -36.45 72.31 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 121.143 -0.973 . . . . 0.0 110.595 -179.785 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.13 -41.07 23.02 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.063 -1.023 . . . . 0.0 109.928 179.756 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.13 48.96 1.05 Allowed 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.212 -0.93 . . . . 0.0 110.485 179.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -92.73 -58.79 2.24 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.14 -0.975 . . . . 0.0 110.323 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -120.64 -58.26 1.84 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.176 -0.952 . . . . 0.0 110.399 -179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -116.99 67.85 0.74 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.203 -0.936 . . . . 0.0 110.241 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.82 -41.26 19.51 Favored Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.491 -1.443 . . . . 0.0 109.491 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.6 ttmt . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.162 -1.199 . . . . 0.0 110.157 179.961 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.0 147.99 44.35 Favored 'Trans proline' 0 C--N 1.316 -1.137 0 O-C-N 123.396 1.209 . . . . 0.0 110.448 179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt -141.28 156.69 45.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.279 -0.888 . . . . 0.0 110.047 -179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.3 t80 -110.85 161.5 15.74 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.14 -0.975 . . . . 0.0 110.188 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -137.4 133.26 34.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.914 . . . . 0.0 110.194 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.1 t -113.91 94.64 4.92 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.118 -0.989 . . . . 0.0 110.173 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -52.85 -35.9 58.12 Favored 'General case' 0 N--CA 1.513 2.689 0 O-C-N 121.025 -1.047 . . . . 0.0 110.478 179.703 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.852 ' CD2' HG13 ' A' ' 34' ' ' VAL . 82.0 m-85 -60.59 -32.91 71.99 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.159 -0.963 . . . . 0.0 110.106 179.2 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 33.9 m -96.63 -3.89 42.0 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.063 -1.023 . . . . 0.0 112.181 -179.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.4 t70 53.69 39.12 29.8 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.383 -1.448 . . . . 0.0 110.458 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.1 t -141.98 170.72 15.18 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.217 -0.927 . . . . 0.0 109.914 179.929 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -119.49 136.74 54.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.256 -0.903 . . . . 0.0 110.611 -179.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.2 mp -96.26 161.88 13.76 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.267 -0.895 . . . . 0.0 109.578 179.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.46 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.9 t -98.57 -21.81 16.29 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.076 -1.015 . . . . 0.0 111.81 -179.691 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 51.6 m-70 -114.37 143.99 44.0 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.709 -1.245 . . . . 0.0 110.022 179.849 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -125.67 92.54 3.63 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 109.715 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -147.43 177.9 1.62 Allowed Pre-proline 0 N--CA 1.496 1.868 0 O-C-N 121.279 -0.888 . . . . 0.0 110.214 -179.518 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.51 -33.26 14.04 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.395 1.208 . . . . 0.0 110.775 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.5 m -84.2 -39.2 19.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.956 -1.09 . . . . 0.0 110.035 179.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 70.1 t -64.38 -45.93 94.5 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.504 0 O-C-N 121.061 -1.024 . . . . 0.0 109.451 179.75 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 -59.71 -52.28 66.17 Favored 'General case' 0 N--CA 1.511 2.614 0 O-C-N 121.175 -0.953 . . . . 0.0 109.351 179.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 43.0 mttm -59.55 -39.67 84.74 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.137 -0.977 . . . . 0.0 108.908 178.865 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.4 m -55.39 -43.68 75.41 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.143 -0.973 . . . . 0.0 108.406 178.318 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -63.49 -40.4 96.99 Favored 'General case' 0 N--CA 1.503 2.18 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 t -92.5 56.95 2.84 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.285 -0.884 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.36 37.9 3.4 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.086 -1.009 . . . . 0.0 110.378 179.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -150.43 123.68 1.6 Allowed Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.91 -29.65 29.7 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.104 -1.233 . . . . 0.0 110.192 178.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 30' ' ' HIS . 6.2 ptpt -57.12 -32.87 66.77 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.009 -1.057 . . . . 0.0 110.724 179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.613 ' O ' HG23 ' A' ' 34' ' ' VAL . 16.4 t-80 -49.82 -41.76 45.54 Favored 'General case' 0 N--CA 1.516 2.845 0 O-C-N 120.978 -1.076 . . . . 0.0 110.737 -179.612 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -62.68 -54.45 39.11 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.16 -0.962 . . . . 0.0 108.986 179.167 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.43 -39.67 88.27 Favored 'General case' 0 N--CA 1.508 2.43 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.108 178.713 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -56.76 -37.6 71.27 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.227 -0.921 . . . . 0.0 110.018 179.118 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.948 HG11 HD12 ' A' ' 50' ' ' ILE . 73.5 t -56.67 -35.95 47.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 121.041 -1.037 . . . . 0.0 110.268 179.71 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.461 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.7 ttmm -57.35 -44.89 84.69 Favored 'General case' 0 N--CA 1.511 2.618 0 O-C-N 120.86 -1.15 . . . . 0.0 109.677 179.357 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -59.29 -25.13 63.86 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.439 -0.904 . . . . 0.0 110.479 178.966 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -75.41 -50.44 15.86 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 120.832 -1.167 . . . . 0.0 110.676 -179.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.461 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 34.5 p90 -99.49 32.96 2.61 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.976 -1.077 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -83.97 -38.43 20.99 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.715 -1.24 . . . . 0.0 109.927 178.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.8 tptt -112.01 32.21 5.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.117 -0.989 . . . . 0.0 110.583 179.409 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.6 t90 -90.82 -39.2 12.49 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.152 -0.968 . . . . 0.0 110.094 -179.972 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 3.2 ttm -150.58 -63.26 0.2 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.224 -0.923 . . . . 0.0 110.552 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -140.47 -171.67 3.27 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.111 -0.993 . . . . 0.0 110.139 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -109.56 39.3 2.13 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.173 -0.955 . . . . 0.0 110.212 179.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -147.37 74.71 1.34 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.229 -0.92 . . . . 0.0 110.241 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.43 ' HB3' ' CE2' ' A' ' 38' ' ' TYR . . . -142.74 72.49 1.37 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.223 -0.923 . . . . 0.0 110.248 -179.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -114.91 36.36 3.89 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.284 -0.885 . . . . 0.0 110.322 179.643 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -111.04 -54.9 2.56 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.189 -0.944 . . . . 0.0 109.415 179.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -20.17 65.29 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.24 -0.912 . . . . 0.0 111.285 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.948 HD12 HG11 ' A' ' 34' ' ' VAL . 49.1 mm -72.79 -52.95 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.463 0 O-C-N 120.719 -1.238 . . . . 0.0 109.705 179.732 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.63 -40.25 86.99 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.197 -0.939 . . . . 0.0 110.075 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 tptp -56.21 -32.23 64.21 Favored 'General case' 0 N--CA 1.511 2.595 0 O-C-N 121.075 -1.015 . . . . 0.0 110.802 -179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 m -85.2 -34.5 22.02 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.961 -1.087 . . . . 0.0 110.816 -179.883 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 81.0 p -85.37 -41.98 14.96 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.969 -1.082 . . . . 0.0 110.001 179.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.67 -34.81 71.66 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.192 -0.943 . . . . 0.0 110.485 179.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.99 -32.49 16.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.013 -1.054 . . . . 0.0 110.878 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.42 -37.87 27.07 Favored 'General case' 0 N--CA 1.519 2.983 0 O-C-N 120.955 -1.09 . . . . 0.0 110.843 -179.615 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -118.33 -68.23 0.93 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.143 -0.973 . . . . 0.0 110.306 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -170.6 -60.64 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.14 -0.975 . . . . 0.0 110.865 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -148.35 -76.43 0.02 OUTLIER Glycine 0 N--CA 1.495 2.618 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.995 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 mttt . . . . . 0 N--CA 1.493 1.717 0 O-C-N 121.283 -1.128 . . . . 0.0 110.226 179.966 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.5 mtt . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.99 124.42 9.6 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 O-C-N 123.397 1.209 . . . . 0.0 110.499 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -119.4 163.29 17.44 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.239 -0.913 . . . . 0.0 109.992 179.904 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 71.7 t80 -115.48 162.12 17.63 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.186 -0.946 . . . . 0.0 110.101 -179.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -140.12 132.51 28.44 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.157 -0.965 . . . . 0.0 110.284 -179.621 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.4 t -113.66 90.09 3.25 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.21 -0.932 . . . . 0.0 109.967 179.403 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -51.65 -35.75 43.37 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.029 -1.044 . . . . 0.0 110.348 179.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.925 ' CD2' HG13 ' A' ' 34' ' ' VAL . 87.1 m-85 -59.56 -31.65 69.63 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.162 -0.962 . . . . 0.0 109.978 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 22.8 m -98.24 0.02 44.92 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.016 -1.053 . . . . 0.0 112.258 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t0 52.63 38.9 27.2 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.381 -1.45 . . . . 0.0 110.666 -179.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -143.21 172.15 13.12 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.32 -0.862 . . . . 0.0 110.029 -179.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -123.6 139.73 53.71 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.287 -0.883 . . . . 0.0 110.871 -179.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -100.44 163.09 12.53 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.264 -0.897 . . . . 0.0 109.36 179.314 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.503 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -100.72 -30.91 11.46 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.064 -1.022 . . . . 0.0 111.849 -179.247 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.503 ' CD2' HG23 ' A' ' 14' ' ' THR . 47.9 m-70 -113.02 134.89 54.31 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.792 -1.193 . . . . 0.0 110.3 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -115.39 82.43 1.75 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.178 -0.951 . . . . 0.0 109.776 179.731 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -126.32 -179.93 1.03 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.288 -0.882 . . . . 0.0 110.008 -179.658 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.24 -29.37 17.32 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.364 1.192 . . . . 0.0 111.099 179.979 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.9 t -88.84 -46.31 9.04 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 120.867 -1.145 . . . . 0.0 110.033 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.46 HG11 ' HB2' ' A' ' 15' ' ' HIS . 91.2 t -58.55 -55.09 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.64 0 O-C-N 121.133 -0.98 . . . . 0.0 109.98 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -55.55 -50.83 68.99 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.067 -1.021 . . . . 0.0 109.85 -179.935 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.5 mttm -61.88 -39.85 93.34 Favored 'General case' 0 N--CA 1.506 2.36 0 C-N-CA 119.298 -0.961 . . . . 0.0 108.867 178.781 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 74.0 m -54.88 -42.95 72.71 Favored 'General case' 0 N--CA 1.512 2.672 0 O-C-N 121.11 -0.994 . . . . 0.0 108.433 178.267 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.6 t60 -62.25 -39.51 93.1 Favored 'General case' 0 N--CA 1.503 2.197 0 C-N-CA 119.602 -0.839 . . . . 0.0 108.887 178.119 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.423 ' CB ' ' CE1' ' A' ' 57' ' ' PHE . 5.4 t -94.7 53.22 1.6 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.287 -0.883 . . . . 0.0 110.417 -179.935 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.34 39.83 3.19 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.088 -1.008 . . . . 0.0 109.992 179.648 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.13 154.07 21.44 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.2 ttp85 -83.83 -10.26 58.17 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.327 -1.102 . . . . 0.0 111.074 178.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 10.3 tttm -90.51 -24.36 20.67 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.696 -1.253 . . . . 0.0 111.115 179.471 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.0 t-80 -48.63 -38.75 21.86 Favored 'General case' 0 N--CA 1.517 2.911 0 O-C-N 120.767 -1.208 . . . . 0.0 110.853 -179.716 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttp -65.53 -53.78 37.36 Favored 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 119.275 -0.97 . . . . 0.0 108.83 179.154 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.29 -39.33 90.05 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.17 -0.956 . . . . 0.0 108.981 178.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -56.66 -37.16 70.43 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.21 -0.931 . . . . 0.0 110.167 179.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.925 HG13 ' CD2' ' A' ' 8' ' ' TYR . 58.0 t -58.62 -43.4 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.024 -1.047 . . . . 0.0 109.726 179.837 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 24.1 ttmt -62.32 -43.25 99.25 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 119.189 -1.004 . . . . 0.0 108.986 179.086 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -60.61 -24.43 65.49 Favored 'General case' 0 N--CA 1.504 2.24 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.295 178.625 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -75.81 -51.83 11.73 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.764 -1.21 . . . . 0.0 110.452 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.516 ' HE2' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -98.94 28.99 4.02 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.002 -1.061 . . . . 0.0 111.643 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -64.08 -41.41 97.32 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 120.66 -1.275 . . . . 0.0 109.664 179.299 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.4 mmmt -117.49 25.91 10.09 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.362 -0.836 . . . . 0.0 111.162 179.583 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.484 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.2 t90 -56.87 -39.25 73.98 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 120.963 -1.085 . . . . 0.0 110.344 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.484 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.2 ttm -147.03 33.55 0.91 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.167 -0.958 . . . . 0.0 110.797 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 49.79 37.59 13.64 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.955 -1.091 . . . . 0.0 111.258 179.692 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -145.01 -171.64 3.68 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.157 -0.964 . . . . 0.0 110.408 -179.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -111.02 128.42 55.85 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.186 -0.946 . . . . 0.0 110.057 179.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -130.4 75.82 1.68 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.286 -0.884 . . . . 0.0 110.314 -179.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.99 35.64 3.17 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.195 -0.94 . . . . 0.0 110.319 179.411 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.9 t -111.26 -55.58 2.48 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.151 -0.968 . . . . 0.0 109.294 179.277 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.88 -20.84 65.53 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.229 -0.92 . . . . 0.0 111.118 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.796 HD12 HG11 ' A' ' 34' ' ' VAL . 47.0 mm -71.91 -49.09 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.668 -1.27 . . . . 0.0 109.546 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.406 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.9 OUTLIER -68.4 -41.37 80.57 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.123 -0.986 . . . . 0.0 109.939 179.881 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.4 mmtm -59.95 -34.98 73.98 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.159 -0.963 . . . . 0.0 110.478 179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.8 m -91.38 -40.15 11.61 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.996 -1.065 . . . . 0.0 110.518 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.578 HG23 ' O ' ' A' ' 50' ' ' ILE . 47.1 p -65.32 -39.37 92.35 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.069 -1.019 . . . . 0.0 110.068 179.941 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.49 -38.38 71.66 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.101 -1.0 . . . . 0.0 110.366 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.55 48.65 1.09 Allowed 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.198 -0.938 . . . . 0.0 110.716 179.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.423 ' CE1' ' CB ' ' A' ' 25' ' ' CYS . 7.2 t80 -92.89 -37.37 12.3 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.151 -0.968 . . . . 0.0 110.373 179.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -111.86 65.84 0.63 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.125 -0.984 . . . . 0.0 110.181 -179.977 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.89 46.73 1.6 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.247 -0.908 . . . . 0.0 110.107 179.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -76.34 -41.16 26.58 Favored Glycine 0 N--CA 1.494 2.55 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 -179.909 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mttp . . . . . 0 N--CA 1.496 1.831 0 O-C-N 121.132 -1.217 . . . . 0.0 110.19 179.969 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 ptp . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.64 146.48 43.65 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.396 1.208 . . . . 0.0 110.41 -179.911 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -132.8 153.12 51.56 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.198 -0.939 . . . . 0.0 110.177 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.637 ' HD2' HD13 ' A' ' 13' ' ' LEU . 84.0 t80 -112.16 162.55 15.32 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.161 -0.962 . . . . 0.0 110.466 -179.534 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -132.22 139.65 48.39 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.15 -0.969 . . . . 0.0 110.223 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 49.4 t -121.06 96.86 5.26 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.08 -1.013 . . . . 0.0 110.098 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -53.53 -36.4 61.74 Favored 'General case' 0 N--CA 1.514 2.75 0 O-C-N 121.061 -1.024 . . . . 0.0 110.407 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.807 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.8 m-85 -60.7 -32.02 71.27 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.095 -1.003 . . . . 0.0 110.125 179.187 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 28.9 m -96.82 -6.07 36.88 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.966 -1.084 . . . . 0.0 112.126 -179.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 t70 54.17 39.45 30.73 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.453 -1.405 . . . . 0.0 110.429 -179.613 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.4 t -144.71 169.92 17.08 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.267 -0.895 . . . . 0.0 110.021 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -115.84 130.94 57.04 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.205 -0.934 . . . . 0.0 110.425 -179.458 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.637 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.5 mp -84.88 169.3 14.25 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.183 -0.948 . . . . 0.0 109.756 179.615 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.633 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.7 t -100.81 -21.83 15.03 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.195 -0.941 . . . . 0.0 112.108 -179.593 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.633 ' CD2' HG23 ' A' ' 14' ' ' THR . 47.3 m-70 -126.26 143.44 51.15 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.616 -1.303 . . . . 0.0 110.315 -179.909 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -120.79 92.04 3.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -139.06 178.21 1.74 Allowed Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 121.227 -0.921 . . . . 0.0 109.985 -179.55 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.66 -29.43 19.58 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.394 1.207 . . . . 0.0 111.114 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.7 t -90.96 -41.61 11.03 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.899 -1.126 . . . . 0.0 110.033 179.612 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.564 HG11 ' HB2' ' A' ' 15' ' ' HIS . 84.7 t -60.11 -49.82 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.53 0 O-C-N 121.152 -0.967 . . . . 0.0 109.807 179.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.8 mtp180 -57.96 -51.67 68.68 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.066 -1.021 . . . . 0.0 109.661 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.6 mtmt -61.81 -40.37 95.03 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.16 -0.962 . . . . 0.0 108.799 178.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 97.5 m -55.16 -43.1 73.95 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.142 -0.974 . . . . 0.0 108.382 178.237 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -63.07 -38.97 93.31 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 177.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.66 50.97 1.14 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.22 -0.925 . . . . 0.0 110.387 -179.852 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 46.7 m -117.79 37.73 3.85 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.096 -1.002 . . . . 0.0 110.313 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -144.77 126.95 2.77 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.2 ttt85 -54.4 -28.44 43.61 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.235 -1.156 . . . . 0.0 110.319 179.078 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -59.2 -34.76 72.54 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.96 -1.088 . . . . 0.0 110.35 179.861 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.704 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.1 t-80 -51.14 -40.19 58.0 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.912 -1.117 . . . . 0.0 110.514 -179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -63.33 -54.68 33.24 Favored 'General case' 0 N--CA 1.506 2.369 0 C-N-CA 119.263 -0.975 . . . . 0.0 109.025 179.182 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.69 -39.52 88.81 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.154 -0.966 . . . . 0.0 109.086 178.68 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 -57.01 -37.76 72.14 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.199 -0.938 . . . . 0.0 110.035 179.18 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.807 HG13 ' CD1' ' A' ' 8' ' ' TYR . 85.8 t -56.5 -34.04 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.593 0 O-C-N 121.093 -1.004 . . . . 0.0 110.253 179.75 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.457 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 23.8 tttp -52.85 -40.95 63.82 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 120.855 -1.153 . . . . 0.0 110.029 179.5 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -59.33 -29.6 67.76 Favored 'General case' 0 N--CA 1.507 2.41 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.261 178.868 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -68.05 -51.55 45.4 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 120.94 -1.1 . . . . 0.0 110.327 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.681 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 45.0 p90 -100.16 35.62 2.04 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.068 -1.02 . . . . 0.0 111.157 179.705 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -87.95 -37.91 16.01 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.863 -1.148 . . . . 0.0 110.001 178.694 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -110.79 29.63 7.57 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.273 -0.892 . . . . 0.0 110.865 179.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.428 ' CD2' ' HE1' ' A' ' 42' ' ' MET . 26.5 t90 -93.98 -42.74 8.89 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.02 -1.05 . . . . 0.0 110.01 179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.428 ' HE1' ' CD2' ' A' ' 41' ' ' TRP . 7.1 tpp -145.59 -60.28 0.34 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.206 -0.934 . . . . 0.0 110.382 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -146.08 -171.17 3.66 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.128 -0.983 . . . . 0.0 110.266 -179.919 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -106.59 39.57 1.81 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.122 -0.986 . . . . 0.0 110.137 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -150.75 76.14 1.24 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.259 -0.9 . . . . 0.0 110.405 179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.681 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -141.15 73.66 1.43 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.17 -0.956 . . . . 0.0 110.297 -179.902 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.22 35.49 4.63 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.597 179.673 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.431 ' OG ' ' N ' ' A' ' 49' ' ' LEU . 5.5 p -110.58 -54.18 2.61 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.068 -1.02 . . . . 0.0 109.463 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 48' ' ' SER . 0.6 OUTLIER -61.47 -20.9 63.66 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.183 -0.948 . . . . 0.0 111.377 179.28 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.55 HD12 HG11 ' A' ' 34' ' ' VAL . 47.3 mm -71.56 -42.64 72.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 120.719 -1.238 . . . . 0.0 109.509 179.685 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.46 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 23.7 t70 -65.22 -39.57 92.95 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.161 -0.962 . . . . 0.0 110.053 -179.998 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 mtmt -64.36 -34.83 79.07 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.08 -1.013 . . . . 0.0 110.626 -179.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.8 m -90.73 -39.09 12.62 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 120.993 -1.067 . . . . 0.0 110.447 179.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 50' ' ' ILE . 17.6 p -57.13 -38.17 73.09 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.0 -1.063 . . . . 0.0 110.372 -179.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.65 -40.4 83.34 Favored 'General case' 0 N--CA 1.51 2.535 0 O-C-N 121.09 -1.006 . . . . 0.0 110.145 179.983 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.07 93.55 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.188 -0.945 . . . . 0.0 110.045 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -53.68 -36.57 62.31 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.055 -1.028 . . . . 0.0 110.641 -179.924 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -97.94 -42.62 7.44 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.089 -1.007 . . . . 0.0 110.271 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 53.76 88.17 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.893 -1.129 . . . . 0.0 110.775 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -110.26 64.47 0.26 Allowed Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 179.934 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.8 ttpp . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.175 -1.191 . . . . 0.0 110.258 -180.0 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.9 ttp . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.73 148.36 46.6 Favored 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.427 1.225 . . . . 0.0 110.29 179.92 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt 61.98 132.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.223 -0.923 . . . . 0.0 110.539 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.402 ' CE2' ' NH1' ' A' ' 21' ' ' ARG . 39.3 t80 -112.26 151.9 29.1 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.041 -1.037 . . . . 0.0 110.19 -179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 75.7 t80 -125.93 137.18 53.69 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.19 -0.944 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 36.2 t -114.77 92.37 3.92 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.213 -0.929 . . . . 0.0 110.061 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -51.45 -35.94 41.87 Favored 'General case' 0 N--CA 1.515 2.806 0 O-C-N 121.093 -1.004 . . . . 0.0 110.361 179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.675 ' CD2' HG13 ' A' ' 34' ' ' VAL . 90.9 m-85 -60.0 -31.08 69.59 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.138 -0.976 . . . . 0.0 110.008 178.882 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.423 ' HB3' HG22 ' A' ' 11' ' ' THR . 32.1 m -98.9 0.84 44.96 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.002 -1.061 . . . . 0.0 112.237 179.916 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.1 38.34 23.93 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.315 -1.491 . . . . 0.0 110.679 -179.662 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.423 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.0 t -146.61 171.68 14.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.987 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.401 ' CD1' ' O ' ' A' ' 4' ' ' PHE . 0.4 OUTLIER -125.94 126.5 44.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.236 -0.915 . . . . 0.0 110.251 -179.73 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.6 mp -77.32 167.43 21.72 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.173 -0.955 . . . . 0.0 109.885 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.401 HG23 ' CG ' ' A' ' 15' ' ' HIS . 14.1 t -100.15 -30.49 11.9 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.137 -0.977 . . . . 0.0 111.635 -179.702 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.472 ' HB2' HG11 ' A' ' 20' ' ' VAL . 35.6 m-70 -110.4 144.63 38.88 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 120.772 -1.205 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -121.87 95.31 4.61 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.201 -0.937 . . . . 0.0 109.819 179.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -142.77 177.93 1.67 Allowed Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.192 -0.943 . . . . 0.0 110.158 -179.578 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 44.2 Cg_endo -71.16 -32.41 13.09 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.396 1.209 . . . . 0.0 110.916 179.859 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.8 t -87.4 -40.02 14.75 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.974 -1.079 . . . . 0.0 110.0 179.588 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.472 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.1 t -61.11 -45.62 98.23 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 O-C-N 121.131 -0.981 . . . . 0.0 109.612 179.724 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 46.8 mtt180 -60.0 -53.79 53.71 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.096 -1.002 . . . . 0.0 109.483 179.617 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -59.79 -39.51 85.2 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.142 -0.974 . . . . 0.0 109.026 178.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.7 m -55.31 -42.79 74.19 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.075 -1.016 . . . . 0.0 108.517 178.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.9 t60 -63.12 -37.05 85.67 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.58 -0.848 . . . . 0.0 109.153 178.116 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -97.8 49.01 1.02 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.116 -0.99 . . . . 0.0 110.509 -179.772 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.8 m -115.51 38.6 3.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.104 -0.997 . . . . 0.0 110.182 179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.2 126.03 2.4 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 -179.929 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 38.8 ttm-85 -53.31 -29.18 32.28 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.115 -1.226 . . . . 0.0 110.398 179.046 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 -33.92 70.14 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.042 -1.036 . . . . 0.0 110.654 179.831 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.9 t-80 -51.34 -38.92 55.67 Favored 'General case' 0 N--CA 1.516 2.84 0 O-C-N 120.908 -1.12 . . . . 0.0 110.603 -179.591 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 tttm -62.99 -53.85 47.53 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.089 179.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.49 -39.26 87.05 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.22 -0.925 . . . . 0.0 108.956 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -55.52 -39.07 70.06 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.212 -0.93 . . . . 0.0 110.083 179.208 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.675 HG13 ' CD2' ' A' ' 8' ' ' TYR . 76.4 t -60.17 -36.44 68.09 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 O-C-N 121.071 -1.018 . . . . 0.0 109.761 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 61.2 tttp -52.75 -40.35 63.01 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.974 -1.078 . . . . 0.0 109.993 179.565 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -57.87 -33.44 68.7 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.28 -0.888 . . . . 0.0 110.128 179.12 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -63.94 -52.63 58.88 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.082 -1.011 . . . . 0.0 109.961 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.588 ' HE2' HG12 ' A' ' 34' ' ' VAL . 48.8 p90 -100.34 33.72 2.59 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.142 -0.973 . . . . 0.0 111.109 179.631 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -81.39 -38.81 25.96 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 120.781 -1.199 . . . . 0.0 110.181 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.5 mtpt -117.08 21.21 13.37 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.244 -0.91 . . . . 0.0 111.636 179.791 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.6 t90 -59.85 -40.0 87.09 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 120.827 -1.171 . . . . 0.0 110.038 -179.997 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.507 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 4.6 mtm -149.9 37.99 0.73 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.151 -0.968 . . . . 0.0 110.59 179.8 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.16 38.18 20.32 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.0 -1.063 . . . . 0.0 110.975 179.924 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -145.99 -172.98 4.04 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.252 -0.905 . . . . 0.0 110.418 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -113.58 125.12 53.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.228 -0.92 . . . . 0.0 110.121 179.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.4 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -124.29 76.17 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.208 -0.932 . . . . 0.0 110.311 -179.836 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.44 ' HG3' ' OH ' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -106.74 36.15 2.74 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.178 -0.951 . . . . 0.0 110.379 179.479 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.6 t -113.12 -54.9 2.58 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.214 -0.928 . . . . 0.0 109.571 179.471 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.77 -22.01 61.55 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.186 -0.946 . . . . 0.0 111.463 179.535 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.561 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -68.34 -47.13 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.475 0 O-C-N 120.606 -1.309 . . . . 0.0 109.371 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -57.54 -36.7 71.97 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.155 -0.966 . . . . 0.0 110.48 179.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -77.18 -34.81 56.24 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.016 -1.053 . . . . 0.0 110.643 179.879 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.4 m -82.53 -38.62 23.52 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.034 -1.041 . . . . 0.0 110.26 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.9 p -56.97 -37.52 71.71 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.09 -1.006 . . . . 0.0 110.452 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.95 -39.6 29.88 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.096 -1.003 . . . . 0.0 109.923 179.627 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.03 64.83 Favored 'General case' 0 N--CA 1.511 2.621 0 O-C-N 121.052 -1.03 . . . . 0.0 110.578 179.829 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -91.24 -40.24 11.64 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.098 -1.001 . . . . 0.0 110.208 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -59.53 -57.25 13.79 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.159 -0.963 . . . . 0.0 110.066 -179.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -140.84 -59.63 0.51 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.23 -0.918 . . . . 0.0 110.276 -179.896 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.17 42.18 4.39 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.204 -1.174 . . . . 0.0 110.216 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ptt? . . . . . 0 N--CA 1.5 2.033 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -71.97 79.76 1.61 Allowed 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.272 1.143 . . . . 0.0 110.285 179.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.4 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 30.3 mttp -136.4 151.07 49.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.296 -0.877 . . . . 0.0 110.113 -179.877 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.614 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.4 t80 -109.62 161.86 14.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.219 -0.926 . . . . 0.0 110.118 179.991 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -136.51 135.33 38.44 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.141 -0.974 . . . . 0.0 110.24 -179.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.8 t -116.84 92.72 3.94 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.146 -0.971 . . . . 0.0 110.001 179.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -51.78 -35.77 45.05 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.014 -1.054 . . . . 0.0 110.408 179.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 92.5 m-85 -60.04 -32.95 71.39 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.133 -0.979 . . . . 0.0 110.004 179.008 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 21.3 m -95.54 -2.83 47.71 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.051 -1.031 . . . . 0.0 112.254 179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.23 39.71 30.12 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.324 -1.485 . . . . 0.0 110.399 -179.645 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.3 t -145.66 171.4 14.77 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.359 -0.838 . . . . 0.0 110.191 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 14.0 t80 -118.41 140.37 49.96 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.246 -0.909 . . . . 0.0 110.565 -179.517 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.614 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.3 mp -96.72 167.19 11.27 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.204 -0.935 . . . . 0.0 109.623 179.517 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.517 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -100.05 -29.81 12.32 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.143 -0.973 . . . . 0.0 111.847 -179.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.694 ' HB2' HG11 ' A' ' 20' ' ' VAL . 51.3 m-70 -113.0 147.58 36.87 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.742 -1.223 . . . . 0.0 110.379 -179.712 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -126.55 93.93 3.92 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.238 -0.914 . . . . 0.0 109.789 179.786 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.402 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -146.61 177.83 1.64 Allowed Pre-proline 0 N--CA 1.495 1.796 0 O-C-N 121.194 -0.941 . . . . 0.0 110.277 -179.598 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.9 Cg_endo -69.95 -27.66 25.31 Favored 'Trans proline' 0 C--N 1.316 -1.153 0 O-C-N 123.383 1.202 . . . . 0.0 111.154 179.824 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.75 -39.0 12.04 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.92 -1.113 . . . . 0.0 110.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.694 HG11 ' HB2' ' A' ' 15' ' ' HIS . 80.8 t -62.93 -49.26 84.33 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.001 -1.062 . . . . 0.0 109.562 179.809 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.8 mtp180 -57.55 -48.43 79.33 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.141 -0.975 . . . . 0.0 109.635 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -62.0 -41.26 97.87 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.196 -0.94 . . . . 0.0 108.725 178.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.4 m -54.21 -43.22 70.61 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 121.18 -0.95 . . . . 0.0 108.439 178.336 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -63.19 -39.39 94.52 Favored 'General case' 0 N--CA 1.503 2.189 0 C-N-CA 119.636 -0.826 . . . . 0.0 108.871 177.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 t -95.3 53.61 1.53 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.223 -0.923 . . . . 0.0 110.349 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.55 37.83 3.79 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.094 -1.004 . . . . 0.0 110.33 179.859 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.79 126.62 2.31 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 110.064 -1.214 . . . . 0.0 110.064 -179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.55 -28.54 46.48 Favored 'General case' 0 N--CA 1.51 2.562 0 O-C-N 121.129 -1.218 . . . . 0.0 110.102 178.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -57.14 -33.05 67.0 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.002 -1.061 . . . . 0.0 110.554 179.581 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -49.36 -37.87 26.23 Favored 'General case' 0 N--CA 1.515 2.804 0 O-C-N 120.99 -1.069 . . . . 0.0 110.915 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -59.65 -56.38 22.58 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.096 -1.002 . . . . 0.0 109.479 179.465 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -59.25 -38.89 81.15 Favored 'General case' 0 N--CA 1.509 2.49 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.227 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -56.54 -36.69 69.53 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.106 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.865 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.3 t -55.65 -35.46 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.616 0 O-C-N 121.056 -1.028 . . . . 0.0 110.31 179.805 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.447 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 13.5 mtpt -52.93 -40.38 63.56 Favored 'General case' 0 N--CA 1.514 2.754 0 O-C-N 120.879 -1.138 . . . . 0.0 110.115 179.935 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.97 -29.95 63.67 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 179.11 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.61 -53.31 23.4 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.907 -1.121 . . . . 0.0 110.094 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 41.1 p90 -100.2 36.01 1.96 Allowed 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.117 -0.99 . . . . 0.0 111.098 179.629 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.71 -36.76 23.46 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 120.705 -1.247 . . . . 0.0 110.359 179.144 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 17.5 mttp -104.8 23.63 13.15 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.217 -0.927 . . . . 0.0 111.229 179.564 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.474 ' CD2' ' CE ' ' A' ' 42' ' ' MET . 13.3 t90 -105.19 -49.87 3.37 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 120.886 -1.134 . . . . 0.0 110.414 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.474 ' CE ' ' CD2' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -104.94 -47.97 3.87 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.142 -0.974 . . . . 0.0 110.38 179.939 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 54.62 38.62 30.25 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.917 -1.114 . . . . 0.0 110.628 -179.854 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -151.77 -65.94 0.18 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.21 -0.931 . . . . 0.0 110.507 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.35 82.41 0.41 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.165 -0.959 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.64 73.04 1.5 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.176 -0.953 . . . . 0.0 110.372 -179.906 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -121.12 33.67 5.47 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.157 -0.964 . . . . 0.0 110.609 179.592 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -108.15 -50.44 3.04 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.027 -1.046 . . . . 0.0 109.825 179.539 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -21.08 63.5 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.179 -0.95 . . . . 0.0 111.475 179.542 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.842 HD12 HG11 ' A' ' 34' ' ' VAL . 48.6 mm -74.36 -38.73 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.405 0 O-C-N 120.673 -1.267 . . . . 0.0 109.944 179.742 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -83.55 -39.21 20.69 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.121 -0.987 . . . . 0.0 110.079 179.752 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -37.89 89.06 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.132 -0.98 . . . . 0.0 110.007 179.596 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.0 m -77.21 -35.89 55.26 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.079 -1.013 . . . . 0.0 110.287 179.756 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.531 HG23 ' O ' ' A' ' 50' ' ' ILE . 82.0 p -81.3 -40.0 24.33 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.053 -1.029 . . . . 0.0 110.066 179.787 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.26 -39.2 82.14 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.168 -0.957 . . . . 0.0 110.118 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -56.17 -39.2 72.01 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.169 -0.957 . . . . 0.0 110.413 -179.95 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -64.91 -67.6 0.42 Allowed 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.179 -0.951 . . . . 0.0 109.841 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 51.48 53.75 12.26 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.044 -1.035 . . . . 0.0 110.85 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -128.06 73.69 1.49 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.181 -0.949 . . . . 0.0 110.224 -180.0 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -113.1 -108.99 2.92 Favored Glycine 0 N--CA 1.493 2.494 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 mttp . . . . . 0 N--CA 1.494 1.731 0 O-C-N 121.303 -1.116 . . . . 0.0 110.174 -179.975 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.402 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 4.1 mtp . . . . . 0 N--CA 1.505 2.307 0 CA-C-O 119.896 -0.097 . . . . 0.0 110.894 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD3' ' HB2' ' A' ' 1' ' ' MET . 48.2 Cg_endo -73.94 99.37 1.16 Allowed 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.131 1.069 . . . . 0.0 110.52 -179.861 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' CB ' ' CE1' ' A' ' 12' ' ' TYR . 53.8 mttp -131.88 153.77 49.88 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.194 -0.941 . . . . 0.0 110.24 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.68 ' HD2' HD13 ' A' ' 13' ' ' LEU . 67.5 t80 -110.14 161.73 15.28 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.226 -0.921 . . . . 0.0 110.06 179.969 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -125.44 133.91 52.29 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.19 -0.944 . . . . 0.0 110.263 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 42.5 t -114.25 99.75 7.84 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.068 -1.02 . . . . 0.0 110.003 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -52.74 -36.02 56.99 Favored 'General case' 0 N--CA 1.512 2.657 0 O-C-N 120.977 -1.077 . . . . 0.0 110.548 179.942 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.865 ' CD1' HG13 ' A' ' 34' ' ' VAL . 94.9 m-85 -62.8 -30.43 71.46 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.097 -1.002 . . . . 0.0 110.267 179.243 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 50.0 m -99.84 -12.04 20.23 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 120.981 -1.074 . . . . 0.0 111.979 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.5 t70 57.14 41.88 26.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 120.405 -1.434 . . . . 0.0 109.972 -179.42 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -143.73 174.23 10.98 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.281 -0.887 . . . . 0.0 110.174 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' CE1' ' CB ' ' A' ' 3' ' ' LYS . 5.7 t80 -115.8 112.72 22.4 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.274 -0.892 . . . . 0.0 110.46 -179.864 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.697 HD21 ' ND1' ' A' ' 24' ' ' HIS . 3.6 mp -65.91 171.27 4.57 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.233 -0.917 . . . . 0.0 109.713 179.688 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.533 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.5 t -97.34 -30.1 13.14 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.235 -0.916 . . . . 0.0 111.549 -179.829 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.741 ' HB2' HG11 ' A' ' 20' ' ' VAL . 44.8 m-70 -115.45 148.87 38.9 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.952 -1.092 . . . . 0.0 110.34 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -126.45 93.97 3.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 109.692 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.41 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -147.24 178.87 1.3 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.201 -0.937 . . . . 0.0 110.082 -179.641 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.58 -31.18 13.89 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.326 1.172 . . . . 0.0 110.971 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.1 t -88.13 -38.78 15.08 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 120.958 -1.089 . . . . 0.0 110.029 179.443 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.741 HG11 ' HB2' ' A' ' 15' ' ' HIS . 64.3 t -61.89 -45.84 97.82 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 O-C-N 121.081 -1.012 . . . . 0.0 109.416 179.568 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 24.5 mtt180 -59.35 -52.24 66.48 Favored 'General case' 0 N--CA 1.509 2.524 0 O-C-N 121.161 -0.962 . . . . 0.0 109.464 179.768 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.16 -41.02 97.9 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.858 178.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.5 m -56.19 -43.22 78.25 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.098 -1.001 . . . . 0.0 108.564 178.249 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.697 ' ND1' HD21 ' A' ' 13' ' ' LEU . 64.8 t60 -61.71 -34.56 76.01 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.613 -0.835 . . . . 0.0 109.27 178.086 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.5 t -100.47 40.35 1.27 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.071 -1.018 . . . . 0.0 110.633 -179.671 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 28.8 m -116.27 38.5 3.37 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.171 -0.956 . . . . 0.0 110.003 179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.65 129.93 4.53 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.59 -1.404 . . . . 0.0 109.59 -179.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -54.57 -28.56 46.82 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.189 -1.183 . . . . 0.0 110.403 179.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 13.5 mmtp -60.07 -36.85 78.27 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 120.964 -1.085 . . . . 0.0 110.475 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -51.38 -36.37 43.02 Favored 'General case' 0 N--CA 1.516 2.838 0 O-C-N 120.942 -1.099 . . . . 0.0 110.632 -179.704 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -55.57 -52.03 65.1 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.0 -1.063 . . . . 0.0 109.768 179.523 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -61.11 -40.53 94.09 Favored 'General case' 0 N--CA 1.508 2.463 0 C-N-CA 119.405 -0.918 . . . . 0.0 108.996 178.778 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -56.56 -37.07 70.03 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.252 -0.905 . . . . 0.0 110.3 179.171 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.929 HG11 HD12 ' A' ' 50' ' ' ILE . 97.6 t -64.94 -37.02 79.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.083 -1.011 . . . . 0.0 110.048 179.8 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.452 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.1 tppt? -53.71 -42.43 68.04 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 120.83 -1.169 . . . . 0.0 109.925 179.594 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.66 -28.04 65.34 Favored 'General case' 0 N--CA 1.507 2.392 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.424 179.067 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -72.86 -51.54 18.33 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 120.893 -1.129 . . . . 0.0 110.528 -179.752 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 38.2 p90 -99.63 35.4 2.0 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.03 -1.044 . . . . 0.0 111.415 179.97 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.68 -39.11 15.27 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 120.828 -1.17 . . . . 0.0 109.98 178.85 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -116.72 34.22 5.18 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.252 -0.905 . . . . 0.0 110.599 179.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.4 t90 -91.51 -39.03 12.16 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.175 -0.953 . . . . 0.0 110.282 -179.853 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.1 mtm -154.32 -67.24 0.14 Allowed 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.121 -0.987 . . . . 0.0 110.579 179.887 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -135.05 -171.82 2.9 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.192 -0.943 . . . . 0.0 110.126 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -110.12 39.42 2.16 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.281 -0.887 . . . . 0.0 110.154 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -146.7 74.33 1.35 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.162 -0.961 . . . . 0.0 110.266 179.876 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -144.41 73.35 1.37 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 -179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -112.95 35.06 4.07 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.113 -0.992 . . . . 0.0 110.502 179.58 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 59.9 p -109.71 -53.48 2.66 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.149 -0.969 . . . . 0.0 109.473 179.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -20.96 63.48 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.216 -0.928 . . . . 0.0 111.339 179.205 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.929 HD12 HG11 ' A' ' 34' ' ' VAL . 49.0 mm -74.33 -47.21 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.413 0 O-C-N 120.66 -1.275 . . . . 0.0 109.701 179.628 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.449 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 8.2 t0 -58.27 -40.03 80.81 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.214 -0.928 . . . . 0.0 110.068 179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.826 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 28.1 mttm -57.41 -35.91 70.65 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.152 -0.968 . . . . 0.0 110.577 179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.4 m -90.89 -39.04 12.52 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.965 -1.084 . . . . 0.0 110.394 179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.449 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 72.3 p -70.98 -35.51 72.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.1 -1.0 . . . . 0.0 110.33 179.641 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.58 -42.37 10.83 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.112 -0.993 . . . . 0.0 110.151 179.735 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.826 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.3 56.51 2.18 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.162 -0.961 . . . . 0.0 110.303 179.632 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -92.6 -56.62 2.95 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.191 -0.943 . . . . 0.0 110.064 179.716 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -144.75 72.63 1.34 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? 52.89 73.46 0.35 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.08 -1.013 . . . . 0.0 110.77 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -102.29 -107.55 3.11 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.728 0 O-C-N 121.178 -1.189 . . . . 0.0 110.247 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.82 171.16 17.95 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 O-C-N 123.284 1.149 . . . . 0.0 110.501 -179.966 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.1 mttt -113.16 155.31 25.21 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.297 -0.877 . . . . 0.0 110.201 -179.951 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -115.23 159.47 20.93 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.191 -0.943 . . . . 0.0 109.768 179.691 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -136.61 139.48 42.13 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.099 -1.001 . . . . 0.0 110.7 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 41.1 t -112.23 96.98 6.33 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.267 -0.896 . . . . 0.0 110.105 179.519 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -54.8 -36.43 64.94 Favored 'General case' 0 N--CA 1.512 2.633 0 O-C-N 121.056 -1.028 . . . . 0.0 110.339 179.865 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.864 ' CD1' HG13 ' A' ' 34' ' ' VAL . 90.0 m-85 -60.44 -32.08 71.02 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.117 -0.989 . . . . 0.0 110.049 179.23 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 27.7 m -96.91 -2.74 43.16 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 120.957 -1.089 . . . . 0.0 112.14 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.7 t70 53.77 38.69 29.08 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.397 -1.44 . . . . 0.0 110.475 -179.545 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -140.1 174.85 10.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.241 -0.912 . . . . 0.0 109.899 179.894 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -120.79 121.77 38.9 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.268 -0.895 . . . . 0.0 110.258 -179.633 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 mp -80.52 166.51 21.11 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.043 -1.036 . . . . 0.0 109.544 179.371 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.516 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -100.89 -29.5 12.19 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.125 -0.984 . . . . 0.0 111.891 -179.535 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.68 ' HB2' HG11 ' A' ' 20' ' ' VAL . 53.0 m-70 -112.23 146.79 37.52 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.824 -1.173 . . . . 0.0 110.276 -179.821 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -125.13 93.51 3.9 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.232 -0.918 . . . . 0.0 109.849 179.919 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.21 178.68 1.36 Allowed Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -71.39 -31.27 14.26 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.267 1.14 . . . . 0.0 110.87 179.888 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -87.16 -40.15 14.86 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.937 -1.102 . . . . 0.0 109.979 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.68 HG11 ' HB2' ' A' ' 15' ' ' HIS . 85.3 t -61.57 -49.03 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 121.183 -0.948 . . . . 0.0 109.476 179.655 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 21.6 mtp-105 -58.39 -50.76 72.51 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.203 -0.936 . . . . 0.0 109.53 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.7 mtpt -62.08 -41.16 97.9 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.111 -0.993 . . . . 0.0 108.803 178.803 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.4 m -55.67 -43.38 76.3 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.13 -0.981 . . . . 0.0 108.451 178.376 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -62.33 -38.76 90.72 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.404 -0.81 . . . . 0.0 108.922 178.02 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.6 t -92.7 55.86 2.53 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.227 -0.921 . . . . 0.0 110.31 -179.988 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.98 37.4 4.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.055 -1.028 . . . . 0.0 110.326 179.789 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.28 128.64 3.46 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.0 ttp-105 -54.64 -28.12 44.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.171 -1.193 . . . . 0.0 110.639 179.353 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -62.47 -34.1 76.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.929 -1.107 . . . . 0.0 110.574 -179.955 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.568 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.7 t-80 -51.58 -41.78 61.43 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.946 -1.096 . . . . 0.0 110.583 -179.595 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -62.54 -54.65 36.7 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.29 -0.964 . . . . 0.0 109.091 179.31 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.76 -39.15 83.9 Favored 'General case' 0 N--CA 1.508 2.471 0 C-N-CA 119.418 -0.913 . . . . 0.0 109.117 178.572 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -55.94 -38.18 69.97 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.227 -0.92 . . . . 0.0 110.069 179.172 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.864 HG13 ' CD1' ' A' ' 8' ' ' TYR . 95.2 t -65.95 -34.51 70.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.464 0 O-C-N 121.148 -0.97 . . . . 0.0 110.025 179.61 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 25.4 tttt -52.14 -39.92 60.64 Favored 'General case' 0 N--CA 1.515 2.78 0 O-C-N 120.909 -1.119 . . . . 0.0 109.983 179.431 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -59.07 -29.49 67.37 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 178.903 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -71.72 -53.09 14.6 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.862 -1.149 . . . . 0.0 110.278 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.687 ' CE1' ' HB3' ' A' ' 46' ' ' ALA . 37.0 p90 -99.27 32.0 2.89 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.068 -1.02 . . . . 0.0 111.448 179.852 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.47 -38.94 54.59 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.728 -1.232 . . . . 0.0 110.138 179.166 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -109.11 31.28 5.83 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.212 -0.93 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.461 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 17.8 t90 -108.51 -57.42 2.13 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.073 -1.017 . . . . 0.0 110.404 -179.758 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.461 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.5 OUTLIER -123.11 54.05 1.27 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.232 -0.918 . . . . 0.0 110.015 -179.989 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 54.3 -171.36 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.022 -1.049 . . . . 0.0 110.581 179.916 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -82.29 -172.86 4.23 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.163 -0.961 . . . . 0.0 110.0 179.987 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 54.76 73.89 0.38 Allowed 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.015 -1.053 . . . . 0.0 110.493 -179.801 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.687 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . . . -148.97 69.99 1.09 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.202 -0.936 . . . . 0.0 110.413 -179.971 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -114.0 33.94 4.94 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.274 -0.891 . . . . 0.0 110.589 179.62 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -105.9 -51.6 2.96 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.053 -1.03 . . . . 0.0 109.309 179.198 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.4 -21.65 62.44 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.239 -0.913 . . . . 0.0 111.355 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.736 HD12 HG11 ' A' ' 34' ' ' VAL . 50.1 mm -79.27 -46.31 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.595 -1.316 . . . . 0.0 109.741 179.633 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -60.72 -37.62 82.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.194 -0.941 . . . . 0.0 110.21 179.887 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.741 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 13.1 tptt -75.74 -35.53 60.18 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.148 -0.97 . . . . 0.0 110.584 179.946 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.9 m -82.81 -39.92 21.08 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.08 -1.012 . . . . 0.0 110.071 179.852 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 50' ' ' ILE . 33.6 p -58.95 -39.08 80.56 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.126 -0.984 . . . . 0.0 110.206 179.874 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.36 -42.37 9.83 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.166 -0.959 . . . . 0.0 110.003 179.674 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.741 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.88 55.47 1.86 Allowed 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.091 -1.006 . . . . 0.0 110.293 179.601 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -92.95 -50.6 5.46 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.213 -0.93 . . . . 0.0 110.217 179.799 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -119.03 48.19 1.53 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.215 -0.928 . . . . 0.0 110.32 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 52.53 79.64 0.11 Allowed 'General case' 0 N--CA 1.501 2.124 0 O-C-N 121.034 -1.041 . . . . 0.0 110.801 179.95 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -107.97 -54.57 0.63 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.4 tttp . . . . . 0 N--CA 1.494 1.759 0 O-C-N 121.25 -1.147 . . . . 0.0 110.17 179.949 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mtt . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.43 160.27 44.93 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.377 1.199 . . . . 0.0 110.358 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.448 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 26.3 mttt 55.07 100.3 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.186 -0.946 . . . . 0.0 110.67 -179.995 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.626 ' HD1' HD13 ' A' ' 13' ' ' LEU . 55.6 t80 -54.65 156.73 3.35 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 121.089 -1.007 . . . . 0.0 110.937 -179.553 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -137.75 129.75 28.82 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.36 -0.838 . . . . 0.0 109.145 179.735 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 23.2 t -109.99 92.69 4.15 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.024 -1.047 . . . . 0.0 110.523 179.89 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -53.13 -35.35 59.59 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.059 -1.026 . . . . 0.0 110.201 179.327 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.828 ' CD1' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -60.44 -34.43 73.97 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.109 -0.995 . . . . 0.0 109.941 179.14 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 37.8 m -96.27 -0.29 49.9 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.089 -1.007 . . . . 0.0 112.136 -179.922 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.55 38.57 26.07 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 120.365 -1.459 . . . . 0.0 110.678 -179.755 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -139.56 166.97 23.17 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.133 -0.979 . . . . 0.0 110.042 179.9 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.448 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 22.4 t80 -120.35 127.11 52.01 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.211 -0.931 . . . . 0.0 110.22 -179.712 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.626 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.0 mp -84.86 167.58 15.87 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.527 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.529 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.3 t -99.47 -31.62 11.55 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.114 -0.991 . . . . 0.0 111.708 -179.34 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.529 ' CD2' HG23 ' A' ' 14' ' ' THR . 36.9 m-70 -117.72 139.43 51.05 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.899 -1.126 . . . . 0.0 110.278 -179.872 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -114.66 94.18 4.66 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.215 -0.928 . . . . 0.0 109.821 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.443 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -139.21 178.72 1.52 Allowed Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.292 -0.88 . . . . 0.0 110.072 -179.653 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.443 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.76 -32.2 14.81 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 O-C-N 123.351 1.185 . . . . 0.0 110.85 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -86.72 -44.4 11.83 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.966 -1.084 . . . . 0.0 109.737 179.44 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 87.2 t -60.43 -51.35 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 121.17 -0.956 . . . . 0.0 109.552 179.674 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.5 mtp-105 -58.49 -50.47 73.62 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.084 -1.01 . . . . 0.0 109.393 179.653 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mtmt -61.32 -40.12 93.05 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.356 -0.938 . . . . 0.0 108.874 178.77 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 68.9 m -54.07 -42.87 69.78 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.105 -0.997 . . . . 0.0 108.562 178.262 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.8 t60 -63.06 -39.85 95.93 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.361 -0.837 . . . . 0.0 108.898 178.135 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.81 56.64 2.35 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.32 -0.862 . . . . 0.0 110.089 -179.912 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.95 37.74 3.56 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.154 -0.966 . . . . 0.0 110.362 179.892 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -149.51 124.59 1.82 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 179.991 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -28.31 39.13 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.075 -1.25 . . . . 0.0 110.4 178.946 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.9 mttt -60.07 -31.34 69.92 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.948 -1.095 . . . . 0.0 110.691 179.771 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.508 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.1 t-80 -49.04 -38.1 22.87 Favored 'General case' 0 N--CA 1.516 2.85 0 O-C-N 120.91 -1.119 . . . . 0.0 110.986 -179.499 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.21 -54.66 29.96 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.014 179.284 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -60.91 -39.28 88.75 Favored 'General case' 0 N--CA 1.508 2.46 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.034 178.703 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -55.94 -37.04 68.44 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.191 -0.943 . . . . 0.0 110.075 179.15 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.828 HG13 ' CD1' ' A' ' 8' ' ' TYR . 50.1 t -55.22 -36.44 39.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.635 0 O-C-N 121.033 -1.042 . . . . 0.0 110.035 179.769 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.451 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 24.4 tttt -57.6 -42.24 82.84 Favored 'General case' 0 N--CA 1.511 2.624 0 O-C-N 120.969 -1.082 . . . . 0.0 109.481 179.309 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -59.18 -26.86 65.17 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.305 178.821 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -70.12 -52.52 23.04 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.893 -1.129 . . . . 0.0 110.406 -179.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.538 ' HE1' HG12 ' A' ' 34' ' ' VAL . 32.8 p90 -97.45 20.94 10.85 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.036 -1.04 . . . . 0.0 111.947 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tm0? -61.48 -40.0 92.97 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 120.6 -1.312 . . . . 0.0 109.848 179.192 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.22 31.38 6.71 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.23 -0.919 . . . . 0.0 110.875 179.723 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.427 ' CE2' ' HE1' ' A' ' 42' ' ' MET . 24.2 t90 -77.29 -59.17 2.89 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.133 -0.979 . . . . 0.0 110.316 -179.855 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.427 ' HE1' ' CE2' ' A' ' 41' ' ' TRP . 7.1 tpp -137.52 -59.55 0.67 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.121 -0.987 . . . . 0.0 110.539 -179.788 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -114.86 -173.54 2.32 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.162 -0.961 . . . . 0.0 110.411 -179.797 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -97.49 -35.78 10.54 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.27 -0.894 . . . . 0.0 110.849 -179.946 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -106.13 83.79 1.95 Allowed 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.93 -1.106 . . . . 0.0 110.399 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.505 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -115.47 70.41 0.75 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.247 -0.908 . . . . 0.0 109.873 179.715 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.66 34.86 4.53 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.199 -0.938 . . . . 0.0 110.54 179.847 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.5 t -107.49 -53.78 2.57 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.087 -1.008 . . . . 0.0 109.213 179.118 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.17 -20.7 64.41 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.307 -0.87 . . . . 0.0 111.31 179.109 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.57 ' O ' HG23 ' A' ' 54' ' ' THR . 49.4 mm -77.58 -40.64 28.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.441 0 O-C-N 120.731 -1.231 . . . . 0.0 109.894 179.797 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -58.53 -38.65 78.22 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.175 -0.953 . . . . 0.0 110.377 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.2 tptp -73.46 -37.35 65.83 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.157 -0.964 . . . . 0.0 110.202 179.772 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.3 m -76.29 -35.96 58.62 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.045 -1.035 . . . . 0.0 110.366 179.742 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.57 HG23 ' O ' ' A' ' 50' ' ' ILE . 60.1 p -76.63 -42.88 40.57 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.001 -1.062 . . . . 0.0 109.983 179.873 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -60.85 -41.7 96.37 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.179 -0.951 . . . . 0.0 109.871 -179.981 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -98.38 32.88 2.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.19 -0.944 . . . . 0.0 111.348 179.672 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.88 -45.27 8.05 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.895 -1.128 . . . . 0.0 110.236 179.832 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -123.6 54.29 1.3 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.159 -0.963 . . . . 0.0 110.386 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -127.45 -58.61 1.25 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.115 -0.991 . . . . 0.0 110.293 179.886 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.18 95.14 1.48 Allowed Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt . . . . . 0 N--CA 1.494 1.753 0 O-C-N 121.244 -1.151 . . . . 0.0 110.17 179.93 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ttt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.77 116.51 4.73 Favored 'Trans proline' 0 C--N 1.317 -1.08 0 O-C-N 123.369 1.194 . . . . 0.0 110.535 179.999 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.41 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 5.8 mtmm -145.55 139.02 26.44 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.193 -0.942 . . . . 0.0 110.248 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.406 ' HD2' HD13 ' A' ' 13' ' ' LEU . 64.6 t80 -111.28 157.86 19.67 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.158 -0.964 . . . . 0.0 110.141 179.95 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -125.95 135.72 52.19 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.164 -0.96 . . . . 0.0 110.62 -179.755 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 43.3 t -113.34 95.0 5.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.188 -0.945 . . . . 0.0 110.019 179.495 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -53.03 -36.08 60.15 Favored 'General case' 0 N--CA 1.512 2.673 0 O-C-N 121.062 -1.024 . . . . 0.0 110.478 179.897 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.836 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.0 m-85 -60.19 -32.96 71.58 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.088 -1.007 . . . . 0.0 109.927 179.108 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.484 ' HB3' HG22 ' A' ' 11' ' ' THR . 25.1 m -95.47 -0.08 52.7 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.011 -1.056 . . . . 0.0 112.061 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.5 t70 51.95 38.57 24.06 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 120.435 -1.416 . . . . 0.0 110.635 -179.783 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.484 HG22 ' HB3' ' A' ' 9' ' ' CYS . 8.6 t -148.9 171.15 16.78 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.291 -0.881 . . . . 0.0 110.149 179.933 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -117.36 124.94 50.15 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.198 -0.939 . . . . 0.0 110.238 -179.664 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.479 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.3 mp -74.2 170.16 16.11 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.132 -0.98 . . . . 0.0 109.784 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.541 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.6 t -101.02 -21.36 15.05 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.236 -0.915 . . . . 0.0 112.176 -179.712 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.716 ' HB2' HG11 ' A' ' 20' ' ' VAL . 48.9 m-70 -119.4 147.28 44.54 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.53 -1.356 . . . . 0.0 110.291 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -124.47 94.84 4.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.22 -0.925 . . . . 0.0 109.961 179.813 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -147.67 177.4 1.79 Allowed Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.187 -0.946 . . . . 0.0 110.413 -179.625 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.86 -32.71 13.58 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 O-C-N 123.41 1.216 . . . . 0.0 110.845 179.849 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 m -87.26 -38.95 15.84 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.043 -1.036 . . . . 0.0 110.027 179.552 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.716 HG11 ' HB2' ' A' ' 15' ' ' HIS . 95.0 t -60.38 -49.31 84.78 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.574 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 179.645 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.405 ' HD3' ' CE1' ' A' ' 4' ' ' PHE . 19.9 mtt180 -58.26 -50.81 72.29 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.079 -1.013 . . . . 0.0 109.605 179.648 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -62.57 -41.33 98.87 Favored 'General case' 0 N--CA 1.507 2.423 0 C-N-CA 119.346 -0.941 . . . . 0.0 108.748 178.825 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.5 m -55.96 -43.29 77.36 Favored 'General case' 0 N--CA 1.511 2.617 0 O-C-N 121.221 -0.924 . . . . 0.0 108.625 178.416 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.479 ' ND1' HD21 ' A' ' 13' ' ' LEU . 76.4 t60 -61.79 -36.25 80.55 Favored 'General case' 0 N--CA 1.504 2.242 0 C-N-CA 119.701 -0.8 . . . . 0.0 109.199 178.218 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.14 52.31 1.28 Allowed 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.135 -0.978 . . . . 0.0 110.274 -179.813 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.8 m -116.49 37.98 3.57 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.137 -0.977 . . . . 0.0 110.244 179.868 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.12 127.1 2.77 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 -179.981 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.7 ttt-85 -54.93 -28.05 47.98 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.097 -1.237 . . . . 0.0 110.342 179.179 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -60.05 -34.45 73.42 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 120.957 -1.09 . . . . 0.0 110.507 179.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.651 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.2 t-80 -51.09 -39.1 55.31 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.948 -1.095 . . . . 0.0 110.537 -179.484 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -63.19 -55.37 25.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.101 -1.0 . . . . 0.0 109.084 179.328 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -59.95 -39.23 84.88 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.23 -0.919 . . . . 0.0 109.199 178.701 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -56.94 -38.18 72.56 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.217 -0.927 . . . . 0.0 110.036 179.272 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.836 HG13 ' CD2' ' A' ' 8' ' ' TYR . 90.0 t -58.19 -35.21 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.154 -0.966 . . . . 0.0 110.067 179.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.45 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 13.9 ttmt -52.27 -40.52 61.87 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.969 -1.082 . . . . 0.0 109.952 179.535 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -58.13 -29.95 65.95 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.577 -0.849 . . . . 0.0 110.298 178.96 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -69.2 -52.8 24.26 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 120.877 -1.14 . . . . 0.0 110.042 179.909 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 40.7 p90 -100.35 35.83 2.02 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.138 -0.976 . . . . 0.0 111.083 179.653 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.54 -38.08 16.32 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.799 -1.188 . . . . 0.0 110.044 178.921 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -107.47 26.75 9.85 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.22 -0.925 . . . . 0.0 110.905 179.433 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 12.1 t90 -106.74 -55.99 2.25 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.966 -1.084 . . . . 0.0 109.893 179.9 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 1.3 mtm -128.64 55.43 1.7 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.252 -0.905 . . . . 0.0 109.713 179.711 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 55.8 -163.48 0.15 Allowed 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.933 -1.104 . . . . 0.0 110.337 -179.968 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -99.74 48.94 0.93 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.13 -0.981 . . . . 0.0 110.221 179.92 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -140.11 73.06 1.41 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.212 -0.93 . . . . 0.0 109.959 179.736 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -158.79 73.4 0.62 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.272 -0.892 . . . . 0.0 110.793 -179.823 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -112.51 35.3 3.88 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.16 -0.962 . . . . 0.0 110.434 179.533 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.9 t -109.06 -52.72 2.73 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.112 -0.992 . . . . 0.0 109.586 179.289 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.47 -20.93 63.7 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.232 -0.918 . . . . 0.0 111.464 179.335 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.756 HD12 HG11 ' A' ' 34' ' ' VAL . 48.7 mm -74.67 -45.95 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 120.747 -1.221 . . . . 0.0 109.835 179.842 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 43.5 m-20 -65.4 -40.7 93.76 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.229 -0.919 . . . . 0.0 110.067 -179.938 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -58.32 -36.75 73.85 Favored 'General case' 0 N--CA 1.51 2.526 0 O-C-N 121.147 -0.971 . . . . 0.0 110.532 -179.926 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 32.2 m -91.4 -39.16 12.15 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.018 -1.052 . . . . 0.0 110.422 179.91 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.604 HG23 ' O ' ' A' ' 50' ' ' ILE . 68.8 p -69.03 -37.51 78.65 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.063 -1.023 . . . . 0.0 110.299 179.941 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.93 -43.26 36.09 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.052 -1.03 . . . . 0.0 109.979 179.9 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -34.79 64.41 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.012 -1.055 . . . . 0.0 110.709 179.97 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -91.51 -31.74 15.84 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 121.01 -1.057 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -97.46 -54.58 3.09 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 120.882 -1.136 . . . . 0.0 110.491 -179.862 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -114.87 48.57 1.13 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.152 -0.968 . . . . 0.0 110.297 -179.898 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -124.94 -110.56 1.83 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.973 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.214 -1.168 . . . . 0.0 110.165 179.991 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -73.21 149.9 46.61 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.488 1.257 . . . . 0.0 110.55 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt -129.18 168.4 16.21 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.223 -0.923 . . . . 0.0 109.985 179.891 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -111.46 160.87 16.71 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.162 -0.961 . . . . 0.0 110.19 -179.907 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -143.68 131.15 21.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.161 -0.962 . . . . 0.0 110.375 -179.48 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.0 t -109.93 87.1 2.43 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.154 -0.967 . . . . 0.0 109.684 179.13 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -50.37 -35.71 29.24 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.11 -0.994 . . . . 0.0 110.937 -179.562 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.843 ' CD2' HG13 ' A' ' 34' ' ' VAL . 25.5 m-85 -61.82 -30.64 70.96 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.084 -1.01 . . . . 0.0 109.919 179.292 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.1 m -98.48 0.52 45.3 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.943 -1.098 . . . . 0.0 112.058 179.674 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 52.89 38.08 25.96 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.395 -1.44 . . . . 0.0 110.839 -179.881 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 t -139.4 168.93 18.71 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.191 -0.943 . . . . 0.0 109.999 179.571 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -121.83 140.27 52.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.175 -0.953 . . . . 0.0 110.886 -179.69 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.4 mp -106.44 152.63 23.38 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.247 -0.908 . . . . 0.0 109.39 179.302 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.485 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -99.1 -30.71 12.15 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.113 -0.992 . . . . 0.0 111.693 -179.519 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.485 ' CD2' HG23 ' A' ' 14' ' ' THR . 50.3 m-70 -111.46 125.3 53.75 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.823 -1.173 . . . . 0.0 110.189 179.989 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -110.2 88.53 2.78 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.114 -0.991 . . . . 0.0 109.742 179.679 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -133.24 -179.78 1.17 Allowed Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 109.81 -179.602 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -71.05 -26.97 20.97 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.271 1.142 . . . . 0.0 111.238 179.885 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.0 m -90.17 -40.22 12.35 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.742 -1.224 . . . . 0.0 110.053 179.482 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.6 t -69.04 -48.35 70.21 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.52 0 O-C-N 121.06 -1.025 . . . . 0.0 109.699 179.727 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.4 mtp85 -59.06 -51.42 70.1 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.079 -1.013 . . . . 0.0 109.467 179.77 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -59.32 -40.2 85.5 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.163 -0.961 . . . . 0.0 108.891 178.862 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 49.7 m -54.67 -43.02 72.06 Favored 'General case' 0 N--CA 1.512 2.655 0 O-C-N 121.07 -1.019 . . . . 0.0 108.303 178.301 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -66.09 -40.93 91.19 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.739 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.66 57.15 2.49 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.322 -0.861 . . . . 0.0 110.093 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -113.34 37.97 3.03 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.047 -1.033 . . . . 0.0 110.453 179.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -153.12 124.49 1.61 Allowed Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.8 ttp-105 -53.76 -28.72 36.31 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.157 -1.202 . . . . 0.0 110.27 179.068 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.3 tttm -59.33 -31.24 68.99 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.12 -0.988 . . . . 0.0 110.701 179.705 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.2 t-80 -48.85 -48.05 42.25 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.927 -1.108 . . . . 0.0 111.175 -179.382 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 mttp -58.86 -53.33 59.57 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.053 -1.029 . . . . 0.0 109.37 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -60.44 -38.98 85.86 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.163 -0.961 . . . . 0.0 109.036 178.556 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 -56.46 -38.98 72.4 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.24 -0.912 . . . . 0.0 110.027 179.249 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.843 HG13 ' CD2' ' A' ' 8' ' ' TYR . 97.3 t -60.17 -38.03 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.509 0 O-C-N 121.092 -1.005 . . . . 0.0 109.76 179.747 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.441 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 27.3 ttmt -53.65 -39.73 65.28 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 120.961 -1.087 . . . . 0.0 109.97 179.441 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -58.63 -34.74 71.51 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.209 -0.932 . . . . 0.0 109.997 179.162 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -64.27 -52.47 58.49 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.036 -1.04 . . . . 0.0 109.931 179.867 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.4 p90 -100.6 35.43 2.15 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.118 -0.989 . . . . 0.0 110.991 179.491 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -84.61 -37.71 20.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 120.8 -1.187 . . . . 0.0 110.267 179.138 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -111.5 21.82 15.75 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.132 -0.98 . . . . 0.0 111.482 179.715 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.453 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 19.7 t90 -60.44 -46.91 88.35 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 120.861 -1.149 . . . . 0.0 109.963 179.949 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.453 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 4.5 mtm -151.68 36.74 0.57 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.155 -0.965 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 50.9 41.63 27.13 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.011 -1.055 . . . . 0.0 110.899 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.4 -168.03 2.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.162 -0.961 . . . . 0.0 110.318 -179.931 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -117.96 124.86 49.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.552 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -125.78 76.7 1.6 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.241 -0.912 . . . . 0.0 110.259 -179.898 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.81 35.71 3.26 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.201 -0.937 . . . . 0.0 110.57 179.673 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 31.3 t -112.77 -55.66 2.5 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.209 -0.932 . . . . 0.0 109.378 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.63 -21.28 64.25 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.225 -0.922 . . . . 0.0 111.064 179.075 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.814 HD12 HG11 ' A' ' 34' ' ' VAL . 47.5 mm -69.92 -41.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.608 -1.307 . . . . 0.0 109.306 179.498 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -71.46 -37.04 71.4 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.19 -0.944 . . . . 0.0 110.327 179.778 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.669 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 62.1 mttt -80.3 -36.31 34.53 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.106 -0.996 . . . . 0.0 110.367 179.778 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 62.2 m -73.32 -37.4 66.17 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.08 -1.013 . . . . 0.0 110.339 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 50' ' ' ILE . 24.0 p -65.56 -40.02 92.35 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.047 -1.033 . . . . 0.0 110.289 -179.887 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.29 -40.55 10.88 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.187 -0.945 . . . . 0.0 110.194 -179.962 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.669 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.36 53.46 1.5 Allowed 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.167 -0.958 . . . . 0.0 110.548 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -92.48 -41.45 10.27 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.141 -0.974 . . . . 0.0 109.852 179.521 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -131.47 39.9 3.46 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.288 -0.882 . . . . 0.0 110.2 179.887 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 52.49 41.03 30.78 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 120.997 -1.064 . . . . 0.0 110.823 -179.955 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.41 -109.59 3.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -179.982 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.7 tttt . . . . . 0 N--CA 1.495 1.789 0 O-C-N 121.202 -1.176 . . . . 0.0 110.212 179.982 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mtp . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.95 115.28 4.29 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.404 1.213 . . . . 0.0 110.468 -179.964 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.437 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 18.2 mtmt -136.87 145.82 44.84 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.205 -0.934 . . . . 0.0 110.05 179.99 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.591 ' HD1' HD13 ' A' ' 13' ' ' LEU . 75.9 t80 -107.74 161.36 14.96 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.132 -0.98 . . . . 0.0 110.283 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -133.83 134.25 42.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.251 -0.906 . . . . 0.0 110.157 -179.714 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.8 t -114.59 96.51 5.79 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.154 -0.966 . . . . 0.0 110.158 179.603 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -53.56 -35.99 61.36 Favored 'General case' 0 N--CA 1.512 2.669 0 O-C-N 120.985 -1.072 . . . . 0.0 110.385 179.805 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.813 ' CD2' HG13 ' A' ' 34' ' ' VAL . 92.6 m-85 -61.24 -32.57 72.37 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.033 -1.042 . . . . 0.0 110.132 179.222 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.4 m -97.08 -4.58 39.25 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.954 -1.091 . . . . 0.0 112.163 -179.982 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 53.47 39.67 30.3 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.371 -1.456 . . . . 0.0 110.442 -179.698 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.98 171.61 13.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.307 -0.871 . . . . 0.0 110.051 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.437 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 12.9 t80 -118.45 133.21 56.06 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.254 -0.904 . . . . 0.0 110.328 -179.753 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.591 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.6 mp -89.11 165.65 14.36 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 121.185 -0.947 . . . . 0.0 109.752 179.588 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.453 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.6 t -98.83 -29.92 12.7 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.134 -0.979 . . . . 0.0 111.698 -179.567 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.744 ' HB2' HG11 ' A' ' 20' ' ' VAL . 46.9 m-70 -111.05 146.36 36.87 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.877 -1.139 . . . . 0.0 110.189 -179.974 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.11 93.19 3.81 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.231 -0.918 . . . . 0.0 109.713 179.854 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.453 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -144.3 178.69 1.37 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.234 -0.916 . . . . 0.0 110.172 -179.594 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.3 Cg_endo -71.15 -30.72 15.71 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.442 1.233 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.73 -40.38 12.55 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 120.996 -1.065 . . . . 0.0 109.988 179.647 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.744 HG11 ' HB2' ' A' ' 15' ' ' HIS . 90.3 t -60.06 -50.46 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.641 179.813 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.414 ' HD3' ' CE2' ' A' ' 4' ' ' PHE . 19.7 mtt180 -58.86 -50.75 72.85 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.102 -0.999 . . . . 0.0 109.513 179.684 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -61.66 -40.29 94.41 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.17 -0.957 . . . . 0.0 108.832 178.817 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 85.7 m -54.53 -43.31 71.81 Favored 'General case' 0 N--CA 1.513 2.677 0 O-C-N 121.1 -1.0 . . . . 0.0 108.358 178.223 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -62.48 -37.78 87.33 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.65 -0.82 . . . . 0.0 109.008 177.814 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -98.07 48.35 1.0 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.133 -0.98 . . . . 0.0 110.442 -179.82 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -117.01 38.02 3.65 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.118 -0.989 . . . . 0.0 110.241 179.757 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.54 128.17 3.28 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 15.1 ttm105 -54.61 -28.5 47.05 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.144 -1.209 . . . . 0.0 110.361 179.128 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.0 mtpp -59.15 -35.56 73.71 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.883 -1.135 . . . . 0.0 110.392 179.772 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.667 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.7 t-80 -51.4 -39.1 56.53 Favored 'General case' 0 N--CA 1.515 2.802 0 O-C-N 121.023 -1.048 . . . . 0.0 110.5 -179.611 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -62.67 -55.6 25.36 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.136 -0.977 . . . . 0.0 109.128 179.406 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -60.13 -39.25 85.62 Favored 'General case' 0 N--CA 1.509 2.517 0 C-N-CA 119.377 -0.929 . . . . 0.0 109.159 178.807 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 -57.36 -37.14 72.15 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.301 -0.875 . . . . 0.0 110.053 179.232 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.974 HG11 HD12 ' A' ' 50' ' ' ILE . 73.0 t -56.86 -37.09 52.14 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.022 -1.049 . . . . 0.0 110.156 179.867 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 10.8 ttpt -54.13 -40.79 67.71 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.913 -1.117 . . . . 0.0 109.718 179.445 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.95 -28.63 66.46 Favored 'General case' 0 N--CA 1.506 2.337 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.359 178.911 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -70.74 -53.11 16.79 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.888 -1.132 . . . . 0.0 110.134 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.434 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 36.7 p90 -99.91 32.66 2.83 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.208 -0.933 . . . . 0.0 111.294 179.625 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -74.17 -35.97 64.05 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 120.73 -1.231 . . . . 0.0 110.258 179.184 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtpp -107.28 27.0 9.51 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.121 -0.987 . . . . 0.0 111.091 179.61 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.448 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 10.6 t90 -109.45 -55.81 2.38 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.055 -1.028 . . . . 0.0 110.047 179.922 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.48 ' O ' ' HB2' ' A' ' 46' ' ' ALA . 3.7 mtm -141.58 57.73 1.51 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.224 -0.923 . . . . 0.0 109.889 179.67 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -51.18 -36.21 40.0 Favored 'General case' 0 N--CA 1.514 2.755 0 O-C-N 121.056 -1.027 . . . . 0.0 110.97 -179.711 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -53.36 -58.69 6.22 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 120.966 -1.084 . . . . 0.0 110.511 -179.852 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -143.82 87.46 1.92 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.161 -0.962 . . . . 0.0 110.155 179.892 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 42' ' ' MET . . . -130.49 71.5 1.46 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.156 -0.965 . . . . 0.0 110.546 -179.888 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -144.3 34.89 1.2 Allowed 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.162 -0.961 . . . . 0.0 110.573 179.426 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -109.05 -53.42 2.65 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.204 -0.935 . . . . 0.0 109.393 179.192 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.96 -20.24 65.04 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 111.249 179.238 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.974 HD12 HG11 ' A' ' 34' ' ' VAL . 51.1 mm -76.85 -51.97 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 120.647 -1.283 . . . . 0.0 109.787 179.806 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 71.1 m-20 -61.2 -39.66 91.04 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.239 -0.913 . . . . 0.0 110.116 179.884 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.1 mmtt -57.12 -37.69 72.34 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.072 -1.018 . . . . 0.0 110.507 -179.794 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.483 HG22 ' HD2' ' A' ' 57' ' ' PHE . 59.9 m -92.46 -44.48 8.64 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.067 -1.021 . . . . 0.0 110.347 179.96 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 50' ' ' ILE . 74.3 p -61.25 -39.37 90.07 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.153 -0.967 . . . . 0.0 110.085 179.94 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.91 -37.95 70.0 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.098 -1.001 . . . . 0.0 110.12 179.827 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.23 28.57 3.57 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.07 -1.019 . . . . 0.0 111.651 179.621 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.483 ' HD2' HG22 ' A' ' 53' ' ' THR . 1.2 t80 -92.93 -40.39 10.62 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.788 -1.195 . . . . 0.0 109.978 179.637 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -108.9 -51.77 2.84 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.203 -0.936 . . . . 0.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 54.35 51.61 13.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.005 -1.059 . . . . 0.0 110.638 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -108.19 44.69 1.44 Allowed Glycine 0 N--CA 1.492 2.418 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.933 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.5 tmtt? . . . . . 0 N--CA 1.494 1.737 0 O-C-N 121.196 -1.179 . . . . 0.0 110.203 -179.923 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.2 ptt? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.52 169.91 20.67 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.439 1.231 . . . . 0.0 110.386 179.954 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.7 mttt 55.55 170.89 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.308 -0.87 . . . . 0.0 110.713 -179.964 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -123.78 162.38 23.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.15 -0.969 . . . . 0.0 110.308 -179.441 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -138.15 134.19 34.26 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.205 -0.935 . . . . 0.0 110.47 -179.603 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.2 t -112.86 94.2 4.79 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.215 -0.928 . . . . 0.0 109.975 179.475 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -51.9 -36.05 47.48 Favored 'General case' 0 N--CA 1.513 2.697 0 O-C-N 121.068 -1.02 . . . . 0.0 110.569 179.95 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.84 ' CD2' HG13 ' A' ' 34' ' ' VAL . 84.0 m-85 -61.2 -32.07 71.83 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.184 -0.947 . . . . 0.0 110.163 179.225 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.9 m -98.74 -4.38 33.62 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.073 -1.017 . . . . 0.0 112.358 -179.864 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 53.57 38.71 28.81 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 120.33 -1.481 . . . . 0.0 110.568 -179.642 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.8 t -139.61 170.9 15.05 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.204 -0.935 . . . . 0.0 109.637 179.785 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -117.77 135.6 53.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.16 -0.963 . . . . 0.0 110.695 -179.592 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.0 mp -100.82 133.36 45.42 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.174 -0.954 . . . . 0.0 109.483 179.391 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.2 t -75.87 -24.08 55.67 Favored 'General case' 0 N--CA 1.51 2.559 0 O-C-N 121.187 -0.945 . . . . 0.0 111.881 -179.392 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.836 ' HB2' HG11 ' A' ' 20' ' ' VAL . 46.8 m-70 -110.93 137.8 48.11 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.761 -1.212 . . . . 0.0 110.428 -179.842 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -125.51 85.99 2.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.274 -0.891 . . . . 0.0 109.671 179.659 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.446 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.04 179.69 1.3 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.268 -0.895 . . . . 0.0 109.906 -179.496 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.446 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -71.01 -31.7 14.57 Favored 'Trans proline' 0 C--N 1.317 -1.131 0 O-C-N 123.329 1.173 . . . . 0.0 110.896 179.911 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.5 m -86.13 -46.57 10.31 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.876 -1.14 . . . . 0.0 109.752 179.305 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.836 HG11 ' HB2' ' A' ' 15' ' ' HIS . 86.2 t -59.54 -52.72 57.68 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.631 0 O-C-N 121.164 -0.96 . . . . 0.0 109.687 179.739 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 40.6 mtm105 -56.39 -52.41 64.7 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.025 -1.047 . . . . 0.0 109.634 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -60.62 -39.9 89.89 Favored 'General case' 0 N--CA 1.508 2.456 0 C-N-CA 119.306 -0.958 . . . . 0.0 108.941 178.82 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 87.1 m -55.31 -43.53 74.94 Favored 'General case' 0 N--CA 1.513 2.682 0 O-C-N 121.044 -1.035 . . . . 0.0 108.313 178.272 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -62.67 -38.87 92.03 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.845 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -97.15 50.03 1.07 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.318 -0.864 . . . . 0.0 110.399 -179.922 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.33 37.47 3.87 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -0.987 . . . . 0.0 110.336 179.89 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.18 127.16 2.78 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 -179.94 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -54.27 -28.65 43.24 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.123 -1.222 . . . . 0.0 110.331 179.092 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -59.18 -33.36 70.85 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 120.949 -1.094 . . . . 0.0 110.57 179.735 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.603 ' O ' HG23 ' A' ' 34' ' ' VAL . 15.5 t-80 -50.58 -39.63 50.13 Favored 'General case' 0 N--CA 1.515 2.81 0 O-C-N 120.979 -1.076 . . . . 0.0 110.803 -179.545 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -54.77 33.15 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.118 -0.988 . . . . 0.0 109.127 179.368 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -60.84 -39.16 88.04 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.203 -0.936 . . . . 0.0 109.052 178.693 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -56.27 -37.29 69.6 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.209 -0.932 . . . . 0.0 110.103 179.057 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.84 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.0 t -55.1 -36.24 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.663 0 O-C-N 121.062 -1.024 . . . . 0.0 110.099 179.609 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 30.9 tttt -54.75 -40.9 69.79 Favored 'General case' 0 N--CA 1.512 2.647 0 O-C-N 120.928 -1.107 . . . . 0.0 109.714 179.328 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.77 -28.02 65.54 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.372 178.975 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -72.29 -52.79 14.69 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.869 -1.145 . . . . 0.0 110.314 -179.966 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 36.8 p90 -99.28 31.12 3.2 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.11 -0.994 . . . . 0.0 111.5 179.732 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.85 -39.53 66.46 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.708 -1.245 . . . . 0.0 110.014 179.251 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.5 tptt -118.81 26.07 9.8 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.265 -0.897 . . . . 0.0 111.235 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 22.8 t90 -69.54 -42.49 74.57 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.962 -1.086 . . . . 0.0 110.078 -179.88 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.498 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.0 ttm -151.09 40.63 0.72 Allowed 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.166 -0.959 . . . . 0.0 110.532 -179.974 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 52.57 -172.05 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.946 -1.096 . . . . 0.0 110.734 179.869 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 53.56 -172.32 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.102 -0.999 . . . . 0.0 110.67 -179.957 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -114.24 130.69 56.63 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.231 -0.918 . . . . 0.0 110.233 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE2' ' A' ' 38' ' ' TYR . . . -120.19 75.29 1.09 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.291 -0.88 . . . . 0.0 110.114 -179.981 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.54 37.11 2.5 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.118 -0.989 . . . . 0.0 110.4 179.703 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 64.1 m -113.91 -55.34 2.51 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.153 -0.967 . . . . 0.0 109.687 179.485 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.03 -21.41 63.58 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.208 -0.933 . . . . 0.0 111.5 179.469 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.567 ' O ' HG23 ' A' ' 54' ' ' THR . 44.8 mm -67.21 -41.73 87.13 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 O-C-N 120.568 -1.332 . . . . 0.0 109.424 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.437 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 3.0 m-20 -63.91 -39.81 95.03 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.21 -0.931 . . . . 0.0 110.087 179.887 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.651 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 55.7 mttt -66.78 -36.43 82.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.148 -0.97 . . . . 0.0 110.33 179.856 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 53.7 m -85.46 -40.05 16.83 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.071 -1.018 . . . . 0.0 110.088 179.747 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.567 HG23 ' O ' ' A' ' 50' ' ' ILE . 21.9 p -58.55 -37.44 75.71 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.09 -1.007 . . . . 0.0 110.21 179.799 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.37 -40.58 11.37 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.105 -0.997 . . . . 0.0 110.156 179.802 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.651 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.85 52.27 1.32 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.085 -1.009 . . . . 0.0 110.498 179.616 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -92.89 -57.76 2.55 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.181 -0.949 . . . . 0.0 110.242 179.672 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -153.5 40.12 0.51 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.231 -0.918 . . . . 0.0 110.622 -179.908 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -121.97 69.13 0.94 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.22 -0.925 . . . . 0.0 110.19 -180.0 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 109.33 109.97 3.3 Favored Glycine 0 N--CA 1.493 2.457 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.983 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.989 0 O-C-N 121.256 -1.144 . . . . 0.0 110.884 179.965 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ptm . . . . . 0 N--CA 1.498 1.954 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.0 77.3 1.96 Allowed 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.252 1.133 . . . . 0.0 110.349 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.1 mtmt -137.4 158.5 44.27 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.16 -0.962 . . . . 0.0 110.034 179.896 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.642 ' HD1' HD13 ' A' ' 13' ' ' LEU . 89.4 t80 -114.91 162.04 17.47 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.126 -0.984 . . . . 0.0 110.405 -179.51 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -137.25 133.05 34.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.243 -0.911 . . . . 0.0 110.01 -179.753 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 34.5 t -112.2 93.21 4.34 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.118 179.475 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -52.29 -36.03 51.87 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 121.026 -1.046 . . . . 0.0 110.367 179.813 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.859 ' CD2' HG13 ' A' ' 34' ' ' VAL . 85.4 m-85 -60.28 -30.88 69.74 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.205 -0.935 . . . . 0.0 110.196 178.982 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 38.1 m -100.81 -2.08 33.17 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.012 -1.055 . . . . 0.0 112.275 -179.713 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.88 38.34 26.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 120.407 -1.433 . . . . 0.0 110.664 -179.653 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -140.2 168.45 19.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.213 -0.929 . . . . 0.0 109.762 179.737 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -118.34 142.59 47.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.2 -0.938 . . . . 0.0 110.619 -179.524 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.642 HD13 ' HD1' ' A' ' 4' ' ' PHE . 4.5 mp -101.37 160.64 14.25 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.211 -0.931 . . . . 0.0 109.769 179.465 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.526 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.3 t -102.51 -30.35 11.03 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.191 -0.943 . . . . 0.0 112.045 -179.286 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.617 ' O ' HG11 ' A' ' 20' ' ' VAL . 48.1 m-70 -113.57 111.76 22.41 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.79 -1.194 . . . . 0.0 110.533 -179.597 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -92.95 67.17 4.3 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.162 -0.961 . . . . 0.0 110.468 179.837 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.445 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -107.39 178.14 1.15 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.155 -0.966 . . . . 0.0 110.009 179.684 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.39 -30.7 15.07 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.332 1.175 . . . . 0.0 111.276 -179.816 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 m -86.89 -41.13 14.24 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.86 -1.15 . . . . 0.0 110.122 179.865 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.617 HG11 ' O ' ' A' ' 15' ' ' HIS . 88.7 t -58.45 -57.04 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 O-C-N 121.073 -1.017 . . . . 0.0 109.914 179.893 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.0 mtt180 -53.69 -50.21 66.35 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 120.947 -1.095 . . . . 0.0 110.094 -179.824 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -62.97 -41.07 99.44 Favored 'General case' 0 N--CA 1.507 2.412 0 C-N-CA 119.213 -0.995 . . . . 0.0 108.741 178.781 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 m -55.05 -43.35 73.72 Favored 'General case' 0 N--CA 1.512 2.649 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.234 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.0 t60 -63.12 -38.49 91.37 Favored 'General case' 0 N--CA 1.502 2.153 0 C-N-CA 119.592 -0.843 . . . . 0.0 108.832 177.908 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 t -97.6 49.55 1.04 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.211 -0.931 . . . . 0.0 110.366 -179.894 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 37.1 m -117.38 37.79 3.78 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.06 -1.025 . . . . 0.0 110.375 179.853 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.11 127.27 2.82 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.792 -1.323 . . . . 0.0 109.792 -179.906 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -54.35 -28.59 43.92 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.151 -1.205 . . . . 0.0 110.323 179.064 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.7 mmmt -59.36 -33.63 71.4 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 120.982 -1.073 . . . . 0.0 110.53 179.764 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.48 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.5 t-80 -50.5 -38.71 45.71 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 120.98 -1.075 . . . . 0.0 110.793 -179.477 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -62.88 -55.63 24.39 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.165 -0.96 . . . . 0.0 109.153 179.31 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -59.4 -38.56 80.89 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.232 -0.917 . . . . 0.0 109.215 178.661 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.27 -38.26 70.95 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.204 -0.935 . . . . 0.0 110.116 179.327 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.859 HG13 ' CD2' ' A' ' 8' ' ' TYR . 75.9 t -58.03 -35.25 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.578 0 O-C-N 121.027 -1.045 . . . . 0.0 110.152 179.667 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 22.1 tttt -52.59 -40.58 62.78 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 121.006 -1.059 . . . . 0.0 110.075 179.613 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -57.94 -28.2 64.09 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.279 -0.888 . . . . 0.0 110.532 178.971 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -71.88 -52.37 17.67 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.856 -1.153 . . . . 0.0 110.386 -179.882 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.487 ' CD2' ' HB3' ' A' ' 46' ' ' ALA . 39.8 p90 -99.49 34.1 2.3 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.033 -1.042 . . . . 0.0 111.479 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -80.35 -39.88 27.73 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.758 -1.214 . . . . 0.0 110.074 179.035 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -117.75 34.64 5.05 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.202 -0.936 . . . . 0.0 110.533 179.711 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 24.9 t90 -92.21 -48.28 6.78 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.122 -0.986 . . . . 0.0 110.539 -179.751 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 7.1 tpp -146.02 -60.83 0.32 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.146 -0.971 . . . . 0.0 110.823 -179.785 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -121.8 -175.84 3.19 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.074 -1.016 . . . . 0.0 110.607 -179.603 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -99.89 -37.14 9.16 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.197 -0.939 . . . . 0.0 110.976 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -104.79 78.83 1.47 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.917 -1.115 . . . . 0.0 110.308 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -116.46 74.76 0.92 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.213 -0.929 . . . . 0.0 110.011 179.804 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.9 35.06 3.37 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.206 -0.933 . . . . 0.0 110.673 179.843 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 m -109.8 -54.5 2.55 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.173 -0.954 . . . . 0.0 109.254 179.084 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.72 -20.92 64.02 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.266 -0.896 . . . . 0.0 111.313 179.184 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.539 HD12 HG11 ' A' ' 34' ' ' VAL . 47.2 mm -72.72 -40.71 61.82 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.479 0 O-C-N 120.701 -1.249 . . . . 0.0 109.663 179.703 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.465 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 10.4 t70 -74.06 -40.76 62.57 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.196 -0.94 . . . . 0.0 109.911 179.919 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.6 mttm -58.33 -34.41 70.58 Favored 'General case' 0 N--CA 1.509 2.521 0 O-C-N 121.211 -0.93 . . . . 0.0 110.692 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 59.6 m -89.93 -44.79 9.66 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.014 -1.054 . . . . 0.0 110.263 -179.942 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.465 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 22.9 p -57.4 -31.53 65.92 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.114 -0.991 . . . . 0.0 110.822 179.945 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.91 -33.71 15.5 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.803 -1.185 . . . . 0.0 111.089 -179.907 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -87.89 -38.53 15.55 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 120.913 -1.117 . . . . 0.0 110.451 -179.89 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -53.23 -36.46 61.06 Favored 'General case' 0 N--CA 1.512 2.671 0 O-C-N 120.998 -1.064 . . . . 0.0 110.691 -179.953 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -111.67 39.16 2.42 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.061 -1.025 . . . . 0.0 110.354 179.855 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -153.14 72.11 0.93 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.191 -0.943 . . . . 0.0 110.528 179.991 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -77.42 -94.13 0.23 Allowed Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.958 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt . . . . . 0 N--CA 1.494 1.773 0 O-C-N 121.198 -1.177 . . . . 0.0 110.225 179.993 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' N ' ' CD ' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.105 0 CA-C-O 119.856 -0.116 . . . . 0.0 110.778 . . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.4 ' CD ' ' N ' ' A' ' 1' ' ' MET . 49.7 Cg_endo -80.02 135.94 11.41 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 O-C-N 123.178 1.094 . . . . 0.0 110.446 -179.768 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -139.55 160.3 40.18 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.221 -0.924 . . . . 0.0 110.091 179.992 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.609 ' HD2' HD13 ' A' ' 13' ' ' LEU . 85.8 t80 -112.08 161.51 16.42 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.122 -0.986 . . . . 0.0 110.207 -179.931 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -136.72 132.38 34.78 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.237 -0.914 . . . . 0.0 110.183 -179.573 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 38.0 t -111.97 94.46 4.95 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.095 -1.003 . . . . 0.0 110.083 179.526 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -52.08 -35.82 48.84 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.133 -0.979 . . . . 0.0 110.538 179.901 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.883 ' CD2' HG13 ' A' ' 34' ' ' VAL . 83.1 m-85 -61.6 -33.36 73.77 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.104 -0.997 . . . . 0.0 110.001 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 36.3 m -96.12 -3.43 44.58 Favored 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.102 -0.999 . . . . 0.0 112.176 179.968 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 52.68 39.33 28.26 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.379 -1.451 . . . . 0.0 110.538 -179.72 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.9 t -141.44 172.72 12.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.254 -0.904 . . . . 0.0 109.942 179.913 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -118.89 139.08 52.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.281 -0.887 . . . . 0.0 110.611 -179.62 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.609 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.9 mp -99.08 168.24 10.2 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.209 -0.932 . . . . 0.0 109.626 179.462 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -98.79 -30.47 12.4 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.122 -0.986 . . . . 0.0 111.6 -179.601 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.766 ' HB2' HG11 ' A' ' 20' ' ' VAL . 45.2 m-70 -114.85 147.73 39.5 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.892 -1.13 . . . . 0.0 110.214 -179.89 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -126.55 90.6 3.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.197 -0.939 . . . . 0.0 109.801 179.94 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.447 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.32 178.32 1.48 Allowed Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.227 -0.92 . . . . 0.0 110.177 -179.708 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 41.7 Cg_endo -70.12 -31.35 19.08 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.448 1.236 . . . . 0.0 110.802 179.856 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -83.41 -36.97 23.84 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 121.056 -1.027 . . . . 0.0 110.057 179.283 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.766 HG11 ' HB2' ' A' ' 15' ' ' HIS . 79.4 t -72.97 -48.81 43.01 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.513 0 O-C-N 121.029 -1.044 . . . . 0.0 109.821 179.677 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.434 ' HD3' ' CD1' ' A' ' 4' ' ' PHE . 21.6 mtm180 -57.27 -52.26 66.06 Favored 'General case' 0 N--CA 1.51 2.574 0 O-C-N 121.072 -1.018 . . . . 0.0 109.764 179.951 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -59.17 -39.52 82.76 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.13 -0.982 . . . . 0.0 109.203 179.056 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 18.3 m -55.98 -43.44 77.58 Favored 'General case' 0 N--CA 1.511 2.62 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.237 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 75.1 t60 -63.04 -40.27 97.21 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.889 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t -93.6 55.83 2.27 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.395 -0.815 . . . . 0.0 110.319 -179.969 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.2 37.34 4.03 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.122 -0.986 . . . . 0.0 110.371 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -146.6 127.3 2.69 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.932 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -28.11 47.31 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.116 -1.226 . . . . 0.0 110.344 179.138 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -60.3 -33.18 71.99 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 120.939 -1.101 . . . . 0.0 110.626 179.775 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.501 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.6 t-80 -49.95 -37.91 34.16 Favored 'General case' 0 N--CA 1.516 2.853 0 O-C-N 120.955 -1.091 . . . . 0.0 110.781 -179.662 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 tttp -62.61 -56.41 18.1 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.086 -1.008 . . . . 0.0 109.166 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -59.04 -38.59 79.68 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.223 -0.923 . . . . 0.0 109.156 178.764 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.3 m-20 -56.59 -37.86 71.21 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.175 -0.953 . . . . 0.0 110.035 179.28 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.883 HG13 ' CD2' ' A' ' 8' ' ' TYR . 77.5 t -57.99 -36.34 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.127 -0.983 . . . . 0.0 109.982 179.756 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 3.7 ttpm? -54.89 -42.29 71.95 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.921 -1.112 . . . . 0.0 109.611 179.488 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -58.08 -28.33 64.48 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.298 -0.876 . . . . 0.0 110.373 178.899 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -70.23 -52.28 24.35 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.915 -1.116 . . . . 0.0 110.292 -179.841 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 41.4 p90 -99.77 34.39 2.28 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.096 -1.003 . . . . 0.0 111.358 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -82.71 -37.28 24.95 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 120.714 -1.241 . . . . 0.0 110.154 178.83 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.4 tttm -110.32 29.43 7.69 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.134 -0.979 . . . . 0.0 110.912 179.587 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.45 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 24.1 t90 -90.77 -40.23 11.93 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.014 -1.054 . . . . 0.0 109.973 179.878 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.45 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -154.89 -66.46 0.13 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.199 -0.938 . . . . 0.0 110.483 179.84 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -124.26 -164.34 1.24 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.196 -0.94 . . . . 0.0 110.09 179.971 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -126.9 38.71 4.05 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.104 -0.997 . . . . 0.0 110.378 179.725 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.8 tt0 -159.13 75.05 0.67 Allowed 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.224 -0.922 . . . . 0.0 110.504 179.886 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -137.17 82.96 1.96 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.137 -0.977 . . . . 0.0 110.349 -179.837 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -109.34 36.08 3.06 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.119 -0.988 . . . . 0.0 110.33 179.617 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.5 m -115.05 -55.55 2.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.088 -1.007 . . . . 0.0 109.608 179.416 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.78 -22.31 61.97 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.222 -0.924 . . . . 0.0 111.153 179.31 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.661 HD12 HG11 ' A' ' 34' ' ' VAL . 45.9 mm -66.39 -39.85 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.458 0 O-C-N 120.646 -1.284 . . . . 0.0 109.291 179.191 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -72.35 -36.16 68.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.226 -0.921 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.709 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 68.2 mttt -76.48 -35.6 58.31 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.036 -1.04 . . . . 0.0 110.615 179.93 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 60.6 m -78.46 -39.85 37.31 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.053 -1.029 . . . . 0.0 110.136 179.944 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' ILE . 18.6 p -60.55 -39.56 88.38 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.138 -0.976 . . . . 0.0 110.144 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.97 -43.21 9.57 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.191 -0.943 . . . . 0.0 110.109 179.759 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.07 57.49 2.41 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.167 -0.958 . . . . 0.0 110.096 179.512 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -92.79 -39.91 10.96 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.241 -0.912 . . . . 0.0 110.247 179.86 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -114.19 48.86 1.05 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.152 -0.967 . . . . 0.0 110.247 179.991 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -130.84 -60.61 0.97 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.259 -0.9 . . . . 0.0 110.137 179.953 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 104.24 68.14 0.74 Allowed Glycine 0 N--CA 1.493 2.492 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.991 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.501 2.09 0 O-C-N 121.064 -1.256 . . . . 0.0 110.814 179.969 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.4 mtm . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.52 121.47 7.46 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.455 1.239 . . . . 0.0 110.464 -179.962 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HB2' ' OH ' ' A' ' 12' ' ' TYR . 32.4 mttm -130.74 157.88 41.63 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.963 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.579 ' HD2' HD13 ' A' ' 13' ' ' LEU . 73.9 t80 -113.1 161.86 16.61 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.082 -1.011 . . . . 0.0 110.292 -179.626 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -131.59 137.46 48.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.237 -0.914 . . . . 0.0 110.232 -179.82 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 48.8 t -116.08 97.9 6.33 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.145 -0.972 . . . . 0.0 109.989 179.512 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -51.93 -35.95 47.48 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 121.061 -1.025 . . . . 0.0 110.737 -179.881 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.841 ' CD2' HG13 ' A' ' 34' ' ' VAL . 88.8 m-85 -63.19 -32.26 73.61 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.091 -1.006 . . . . 0.0 110.167 179.38 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 54.8 m -98.2 -8.94 26.47 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.058 -1.026 . . . . 0.0 112.024 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 54.87 41.0 32.25 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.344 -1.472 . . . . 0.0 110.188 -179.428 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.0 t -142.09 173.28 11.66 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.246 -0.909 . . . . 0.0 110.025 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.444 ' OH ' ' HB2' ' A' ' 3' ' ' LYS . 5.1 t80 -120.08 131.52 55.11 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.577 -179.6 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.579 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.1 mp -88.84 170.45 10.72 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.143 -0.973 . . . . 0.0 109.7 179.48 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.5 HG23 ' CD2' ' A' ' 15' ' ' HIS . 15.2 t -96.93 -31.29 12.63 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.302 -0.873 . . . . 0.0 111.375 -179.83 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.724 ' HB2' HG11 ' A' ' 20' ' ' VAL . 50.4 m-70 -112.24 146.75 37.6 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.824 -1.173 . . . . 0.0 110.125 179.916 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -126.27 93.96 3.95 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.209 -0.932 . . . . 0.0 109.861 179.919 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.456 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -148.63 178.47 1.45 Allowed Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.182 -0.949 . . . . 0.0 110.312 -179.533 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.0 Cg_endo -70.46 -32.87 14.9 Favored 'Trans proline' 0 C--N 1.316 -1.167 0 O-C-N 123.384 1.202 . . . . 0.0 110.852 179.873 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 29.8 m -83.99 -39.87 19.16 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.965 -1.085 . . . . 0.0 109.839 179.396 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.724 HG11 ' HB2' ' A' ' 15' ' ' HIS . 58.4 t -65.74 -47.39 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.438 0 O-C-N 121.081 -1.012 . . . . 0.0 109.642 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.3 mtp180 -57.19 -50.83 71.61 Favored 'General case' 0 N--CA 1.512 2.626 0 O-C-N 121.127 -0.983 . . . . 0.0 109.565 179.777 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -61.48 -40.96 96.46 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.22 -0.925 . . . . 0.0 108.732 178.803 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -54.19 -43.22 70.54 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.178 -0.951 . . . . 0.0 108.524 178.33 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -62.33 -37.71 86.67 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.348 -0.845 . . . . 0.0 108.853 178.076 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.8 t -96.58 51.66 1.18 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.202 -0.936 . . . . 0.0 110.317 -179.861 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m -117.1 37.64 3.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.341 179.833 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -145.28 128.34 3.12 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.781 -1.328 . . . . 0.0 109.781 -179.919 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -28.61 45.54 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.136 -1.214 . . . . 0.0 110.351 179.172 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -59.37 -34.9 72.97 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.029 -1.044 . . . . 0.0 110.393 179.764 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.578 ' O ' HG23 ' A' ' 34' ' ' VAL . 12.3 t-80 -51.22 -39.01 55.63 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 120.961 -1.087 . . . . 0.0 110.571 -179.613 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -61.9 -55.09 33.29 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.375 -0.93 . . . . 0.0 109.114 179.27 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.94 -38.84 83.6 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.217 -0.927 . . . . 0.0 109.193 178.65 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.35 -36.96 71.85 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.091 -1.005 . . . . 0.0 110.203 179.156 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.958 HG11 HD12 ' A' ' 50' ' ' ILE . 72.2 t -57.85 -35.39 51.31 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.08 -1.012 . . . . 0.0 110.32 179.993 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 17.8 mmmt -52.65 -39.44 61.81 Favored 'General case' 0 N--CA 1.515 2.815 0 O-C-N 120.877 -1.14 . . . . 0.0 109.957 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.44 -28.82 65.64 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.294 -0.879 . . . . 0.0 110.29 178.9 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -73.28 -54.11 9.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 120.853 -1.154 . . . . 0.0 109.852 179.843 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 31.6 p90 -98.56 31.73 2.78 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.088 -1.008 . . . . 0.0 111.508 179.88 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.88 -38.41 64.4 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.739 -1.226 . . . . 0.0 109.777 178.948 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.4 22.58 13.95 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.253 -0.904 . . . . 0.0 111.114 179.176 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.525 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.3 t90 -101.5 -49.31 4.07 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.908 -1.12 . . . . 0.0 109.804 179.662 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.525 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 28.2 mmt -111.98 -53.02 2.75 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.245 -0.91 . . . . 0.0 110.245 179.701 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 54.79 39.31 31.33 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.986 -1.071 . . . . 0.0 110.674 179.99 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -149.04 -66.29 0.23 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.179 -0.95 . . . . 0.0 110.439 179.888 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -166.89 77.26 0.19 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.193 -0.942 . . . . 0.0 110.851 -179.982 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -132.42 73.4 1.53 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.233 -0.917 . . . . 0.0 110.301 -179.799 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.09 33.62 5.32 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.162 -0.962 . . . . 0.0 110.524 179.445 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.1 p -107.27 -50.82 3.01 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.096 -1.002 . . . . 0.0 109.678 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.36 -21.84 60.45 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.219 -0.926 . . . . 0.0 111.527 179.369 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.958 HD12 HG11 ' A' ' 34' ' ' VAL . 50.5 mm -76.66 -39.72 32.24 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.399 0 O-C-N 120.716 -1.24 . . . . 0.0 109.925 179.777 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.466 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 31.7 t0 -80.39 -40.72 25.97 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.153 -0.967 . . . . 0.0 109.958 179.758 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.749 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 24.2 ttmt -58.06 -33.24 68.82 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -0.91 . . . . 0.0 110.685 179.816 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.4 m -86.76 -41.3 14.23 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 120.997 -1.064 . . . . 0.0 110.109 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.613 HG23 ' O ' ' A' ' 50' ' ' ILE . 27.4 p -59.38 -37.68 78.54 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.124 -0.985 . . . . 0.0 110.134 179.897 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.48 -40.98 11.09 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.14 -0.975 . . . . 0.0 110.154 179.761 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.749 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -95.24 53.98 1.59 Allowed 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.151 -0.968 . . . . 0.0 110.293 179.597 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -93.25 -48.28 6.52 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.196 -0.94 . . . . 0.0 110.062 179.785 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.1 mm-40 -132.52 74.94 1.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.234 -0.916 . . . . 0.0 110.098 179.945 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -124.08 -60.08 1.45 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.106 -0.996 . . . . 0.0 110.247 -179.948 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 113.85 70.62 0.53 Allowed Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt . . . . . 0 N--CA 1.496 1.866 0 O-C-N 121.228 -1.16 . . . . 0.0 110.286 -179.946 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.47 145.91 43.44 Favored 'Trans proline' 0 C--N 1.318 -1.074 0 O-C-N 123.374 1.197 . . . . 0.0 110.334 179.952 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 34.7 mttt -147.61 144.33 28.35 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 110.561 -179.835 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.564 ' HD2' HD13 ' A' ' 13' ' ' LEU . 57.3 t80 -112.69 155.28 24.77 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.213 -0.93 . . . . 0.0 109.816 179.552 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 13.7 t80 -134.28 139.55 45.8 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.158 -0.964 . . . . 0.0 110.532 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 35.0 t -111.34 98.39 7.45 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.258 -0.901 . . . . 0.0 110.185 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -53.52 -35.79 61.05 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.148 -0.97 . . . . 0.0 110.462 179.72 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.85 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.1 m-85 -63.01 -33.12 74.74 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.105 -0.997 . . . . 0.0 110.306 179.44 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 68.4 m -98.75 -2.83 37.13 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.005 -1.059 . . . . 0.0 112.082 179.855 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 53.8 37.98 27.57 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.37 -1.456 . . . . 0.0 110.801 -179.947 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 t -131.32 171.66 13.08 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.168 -0.957 . . . . 0.0 109.98 179.697 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.412 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 0.6 OUTLIER -125.06 107.64 11.01 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.251 -0.905 . . . . 0.0 110.12 179.852 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.564 HD13 ' HD2' ' A' ' 4' ' ' PHE . 3.6 mp -67.31 166.74 13.74 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.167 -0.958 . . . . 0.0 109.854 -179.999 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.19 -30.42 11.93 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.266 -0.896 . . . . 0.0 111.628 -179.694 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.52 ' CD2' HG23 ' A' ' 14' ' ' THR . 42.0 m-70 -115.85 139.76 49.89 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.819 -1.175 . . . . 0.0 110.184 -179.897 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -116.02 92.04 3.78 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.255 -0.903 . . . . 0.0 109.901 179.746 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.44 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -137.83 177.92 1.92 Allowed Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.234 -0.916 . . . . 0.0 110.01 -179.637 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.44 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.7 Cg_endo -70.32 -31.41 18.09 Favored 'Trans proline' 0 C--N 1.316 -1.146 0 O-C-N 123.364 1.191 . . . . 0.0 110.974 179.995 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -43.78 11.72 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.972 -1.08 . . . . 0.0 109.842 179.501 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.435 HG11 ' HB2' ' A' ' 15' ' ' HIS . 92.8 t -60.12 -49.57 83.57 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 O-C-N 121.222 -0.924 . . . . 0.0 109.636 179.842 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.8 mtp-105 -59.61 -50.85 72.26 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.038 -1.039 . . . . 0.0 109.332 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -61.07 -39.96 91.85 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.214 -0.929 . . . . 0.0 108.85 178.821 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.9 m -54.37 -42.84 70.79 Favored 'General case' 0 N--CA 1.511 2.62 0 O-C-N 121.057 -1.027 . . . . 0.0 108.611 178.32 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -62.73 -37.47 86.69 Favored 'General case' 0 N--CA 1.504 2.25 0 C-N-CA 119.63 -0.828 . . . . 0.0 109.109 178.066 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 t -96.8 49.54 1.09 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.156 -0.965 . . . . 0.0 110.529 -179.727 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.8 m -115.89 40.31 2.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.096 -1.002 . . . . 0.0 109.782 179.563 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -136.37 148.96 19.95 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.853 -1.299 . . . . 0.0 109.853 -179.666 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.2 tmm_? -79.64 -9.11 59.58 Favored 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.298 -1.119 . . . . 0.0 111.064 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 16.1 tttp -91.47 -21.34 20.97 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.678 -1.264 . . . . 0.0 111.449 179.657 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.488 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.9 t-80 -48.49 -37.52 17.67 Favored 'General case' 0 N--CA 1.518 2.953 0 O-C-N 120.743 -1.223 . . . . 0.0 110.968 -179.559 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.6 tttt -63.11 -54.26 40.71 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.092 -1.005 . . . . 0.0 108.981 179.241 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -60.26 -39.2 85.99 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 119.449 -0.9 . . . . 0.0 109.0 178.609 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -55.88 -37.37 68.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.167 -0.958 . . . . 0.0 110.103 179.218 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.85 HG13 ' CD2' ' A' ' 8' ' ' TYR . 69.4 t -56.13 -35.34 41.59 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.615 0 O-C-N 120.993 -1.067 . . . . 0.0 110.066 179.567 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 7.5 tptm -52.4 -39.93 61.5 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 120.905 -1.122 . . . . 0.0 110.056 179.562 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.67 -29.6 64.76 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.29 -0.881 . . . . 0.0 110.366 179.024 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -69.96 -53.04 19.56 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 120.901 -1.124 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.455 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 39.2 p90 -100.0 34.76 2.21 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.124 -0.985 . . . . 0.0 111.227 179.793 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.08 -35.86 23.44 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.744 -1.222 . . . . 0.0 110.3 178.978 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -105.17 23.23 13.99 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.043 -1.035 . . . . 0.0 111.289 179.553 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.519 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 14.9 t90 -99.76 -45.28 5.8 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 120.855 -1.153 . . . . 0.0 110.152 179.89 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.519 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -124.34 42.18 3.32 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.125 -0.984 . . . . 0.0 110.094 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 62.12 -75.46 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.294 -0.878 . . . . 0.0 110.919 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -168.97 44.36 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.089 0 O-C-N 120.775 -1.203 . . . . 0.0 111.124 -179.927 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -147.47 75.38 1.36 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 179.954 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -155.93 74.57 0.86 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.25 -0.906 . . . . 0.0 110.74 -179.989 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -118.43 36.62 4.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.178 -0.951 . . . . 0.0 110.518 179.676 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.6 m -113.22 -54.94 2.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.183 -0.948 . . . . 0.0 109.721 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.94 -21.55 63.54 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.288 -0.883 . . . . 0.0 111.328 179.405 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.784 HD12 HG11 ' A' ' 34' ' ' VAL . 46.8 mm -68.88 -40.93 81.8 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 120.693 -1.255 . . . . 0.0 109.464 179.597 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.75 -41.35 17.72 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.17 -0.956 . . . . 0.0 109.76 179.663 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -60.86 -32.41 71.83 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.288 -0.883 . . . . 0.0 110.457 179.676 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.564 HG22 ' CD2' ' A' ' 57' ' ' PHE . 83.3 m -88.31 -39.85 14.05 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 120.977 -1.077 . . . . 0.0 110.323 -179.975 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.476 HG23 ' O ' ' A' ' 50' ' ' ILE . 31.4 p -67.82 -39.91 83.86 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.106 -0.996 . . . . 0.0 109.901 179.761 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.13 -33.73 63.13 Favored 'General case' 0 N--CA 1.51 2.557 0 O-C-N 121.113 -0.992 . . . . 0.0 110.886 179.969 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -90.2 -39.51 12.76 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.065 -1.022 . . . . 0.0 110.273 179.976 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.564 ' CD2' HG22 ' A' ' 53' ' ' THR . 1.8 m-85 -57.3 -38.33 73.83 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.152 -0.968 . . . . 0.0 110.25 -179.973 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.7 mm-40 -112.97 -59.44 2.02 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.057 -1.027 . . . . 0.0 110.207 179.874 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 52.52 70.38 0.58 Allowed 'General case' 0 N--CA 1.502 2.125 0 O-C-N 121.091 -1.006 . . . . 0.0 110.777 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -120.51 41.74 1.87 Allowed Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.989 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.1 tttt . . . . . 0 N--CA 1.494 1.769 0 O-C-N 121.219 -1.165 . . . . 0.0 110.18 -179.964 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.0 mtm . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.92 148.19 45.12 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.347 1.182 . . . . 0.0 110.427 -179.986 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 12' ' ' TYR . 91.4 mttt -127.67 149.69 50.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.19 -0.944 . . . . 0.0 110.147 -179.994 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 13' ' ' LEU . 44.7 t80 -104.57 148.85 26.05 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.3 -0.875 . . . . 0.0 109.465 179.47 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -125.08 130.15 51.66 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.2 -0.938 . . . . 0.0 110.542 -179.407 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.0 t -109.98 93.87 4.72 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.182 -0.949 . . . . 0.0 109.686 179.375 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -51.74 -36.41 47.04 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 121.158 -0.964 . . . . 0.0 111.035 -179.427 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.882 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -63.1 -33.31 75.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.053 -1.029 . . . . 0.0 110.114 179.461 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 65.4 m -96.42 -4.23 42.12 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.002 -1.061 . . . . 0.0 111.952 179.605 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 53.68 47.25 24.21 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.428 -1.42 . . . . 0.0 110.66 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 t -140.95 171.26 14.32 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.265 -0.897 . . . . 0.0 110.373 179.852 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.456 ' CE2' ' CD ' ' A' ' 3' ' ' LYS . 12.1 t80 -126.66 104.68 8.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.238 -0.914 . . . . 0.0 109.88 -179.991 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.678 HD13 ' CD2' ' A' ' 4' ' ' PHE . 3.4 mp -65.22 163.48 15.16 Favored 'General case' 0 N--CA 1.507 2.377 0 C-N-CA 119.512 -0.875 . . . . 0.0 109.868 -179.739 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.491 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -99.3 -31.05 11.89 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.199 -0.938 . . . . 0.0 111.591 -179.611 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.491 ' CD2' HG23 ' A' ' 14' ' ' THR . 42.0 m-70 -114.23 136.42 52.98 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.823 -1.173 . . . . 0.0 110.076 180.0 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -114.31 92.09 3.84 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.155 -0.966 . . . . 0.0 109.849 179.66 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.433 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -136.12 179.04 1.47 Allowed Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.232 -0.918 . . . . 0.0 109.983 -179.601 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.433 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -71.16 -30.84 15.52 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.293 1.154 . . . . 0.0 111.028 179.994 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.1 m -89.27 -43.73 10.76 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.942 -1.099 . . . . 0.0 109.887 179.607 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.42 HG11 ' HB2' ' A' ' 15' ' ' HIS . 94.9 t -59.26 -52.48 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.58 0 O-C-N 121.121 -0.987 . . . . 0.0 109.833 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 24.3 mtp-105 -58.2 -50.08 74.81 Favored 'General case' 0 N--CA 1.512 2.63 0 O-C-N 121.135 -0.978 . . . . 0.0 109.511 179.817 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.8 mmmt -61.47 -40.06 93.16 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 119.291 -0.963 . . . . 0.0 108.88 178.72 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 m -54.29 -43.03 70.71 Favored 'General case' 0 N--CA 1.512 2.644 0 O-C-N 121.109 -0.994 . . . . 0.0 108.539 178.269 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.6 t60 -62.7 -37.91 88.34 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 119.703 -0.799 . . . . 0.0 108.96 177.961 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t -96.92 52.09 1.15 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.178 -0.952 . . . . 0.0 110.188 180.0 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.37 38.05 3.36 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.051 -1.031 . . . . 0.0 110.392 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -147.78 126.47 2.37 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 109.896 -1.282 . . . . 0.0 109.896 179.976 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -53.95 -28.72 38.98 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.107 -1.231 . . . . 0.0 110.378 179.217 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -60.4 -31.54 70.47 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.028 -1.045 . . . . 0.0 110.645 179.846 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.535 ' O ' HG23 ' A' ' 34' ' ' VAL . 14.3 t-80 -49.52 -37.97 28.86 Favored 'General case' 0 N--CA 1.516 2.832 0 O-C-N 120.933 -1.105 . . . . 0.0 110.964 -179.564 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.6 ttpp -62.23 -54.23 43.78 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 121.072 -1.018 . . . . 0.0 109.118 179.3 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -60.38 -38.43 83.89 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.436 -0.906 . . . . 0.0 109.123 178.612 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -56.57 -37.65 70.87 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.274 -0.891 . . . . 0.0 110.18 179.321 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.908 HG11 HD12 ' A' ' 50' ' ' ILE . 95.1 t -59.62 -39.32 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.546 0 O-C-N 121.123 -0.986 . . . . 0.0 109.722 179.645 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 52.3 mttt -54.06 -40.91 67.59 Favored 'General case' 0 N--CA 1.511 2.597 0 O-C-N 121.016 -1.052 . . . . 0.0 109.606 179.331 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -57.42 -34.92 69.44 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.597 -0.841 . . . . 0.0 110.052 178.993 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -62.15 -52.56 63.36 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.002 -1.061 . . . . 0.0 109.602 179.649 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.674 ' HE1' HG12 ' A' ' 34' ' ' VAL . 49.8 p90 -100.94 38.0 1.63 Allowed 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.276 -0.89 . . . . 0.0 110.781 179.412 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -87.0 -37.35 17.6 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.927 -1.108 . . . . 0.0 110.067 178.874 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -98.35 19.25 14.7 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.179 -0.951 . . . . 0.0 111.179 179.244 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.434 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 17.6 t90 -105.86 -55.98 2.25 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.809 -1.182 . . . . 0.0 109.971 179.704 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 5.1 tpp -143.14 57.98 1.4 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.317 -0.864 . . . . 0.0 109.855 179.963 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.22 89.23 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.525 0 O-C-N 121.206 -0.934 . . . . 0.0 110.254 -179.69 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.08 -58.73 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.249 -0.907 . . . . 0.0 110.733 179.891 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -159.71 76.32 0.65 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.302 -0.873 . . . . 0.0 110.722 179.868 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.15 71.0 1.42 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.182 -0.949 . . . . 0.0 110.386 -179.816 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -124.67 32.81 5.37 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.174 -0.954 . . . . 0.0 110.657 179.406 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 p -104.07 -48.67 3.82 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.08 -1.012 . . . . 0.0 109.568 179.297 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -21.25 62.78 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.169 -0.957 . . . . 0.0 111.469 179.491 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.908 HD12 HG11 ' A' ' 34' ' ' VAL . 50.3 mm -82.12 -53.11 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 O-C-N 120.646 -1.284 . . . . 0.0 109.945 179.728 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.454 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 22.0 t0 -56.88 -39.57 74.6 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.135 -0.978 . . . . 0.0 110.32 -179.855 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 60.5 mttt -57.14 -36.57 70.87 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.148 -0.97 . . . . 0.0 110.54 -179.922 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m -91.64 -37.5 13.02 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.074 -1.016 . . . . 0.0 110.483 179.948 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.454 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 68.5 p -73.13 -34.69 66.25 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.081 -1.012 . . . . 0.0 110.538 179.972 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.26 -40.17 16.92 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.903 -1.123 . . . . 0.0 110.073 179.849 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.401 ' HB2' ' O ' ' A' ' 52' ' ' LYS . . . -56.73 -34.49 67.56 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.071 -1.018 . . . . 0.0 110.622 179.918 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -87.58 -34.67 18.46 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.029 -1.044 . . . . 0.0 110.694 179.945 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -101.5 57.11 0.84 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.99 -1.069 . . . . 0.0 110.119 179.81 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -116.59 -56.96 2.24 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.062 -1.024 . . . . 0.0 110.104 179.856 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -109.99 -58.49 0.51 Allowed Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.488 -1.445 . . . . 0.0 109.488 179.93 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.3 mttm . . . . . 0 N--CA 1.494 1.757 0 O-C-N 121.278 -1.131 . . . . 0.0 110.155 179.964 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.52 153.62 55.03 Favored 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.417 1.22 . . . . 0.0 110.523 179.966 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 20.3 mtmt -144.64 153.29 41.6 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.245 -0.909 . . . . 0.0 110.36 -179.946 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.45 ' CE1' ' CZ ' ' A' ' 21' ' ' ARG . 40.7 t80 -113.53 154.42 27.13 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.286 -0.884 . . . . 0.0 109.609 179.564 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -126.45 133.82 51.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.053 -1.029 . . . . 0.0 110.538 -179.851 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 45.9 t -109.8 97.7 7.18 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.216 -0.928 . . . . 0.0 110.207 179.502 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -54.32 -36.57 63.89 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 121.094 -1.004 . . . . 0.0 110.272 179.715 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.623 ' CD1' HG13 ' A' ' 34' ' ' VAL . 91.0 m-85 -59.84 -32.37 70.61 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.185 179.082 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.426 ' CB ' HG22 ' A' ' 11' ' ' THR . 33.8 m -97.02 -1.81 44.7 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.984 -1.073 . . . . 0.0 112.098 -179.894 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 52.63 39.17 27.79 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 120.352 -1.468 . . . . 0.0 110.399 -179.589 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 9' ' ' CYS . 9.3 t -145.83 175.31 10.51 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.174 -179.972 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 0.3 OUTLIER -122.03 122.67 39.85 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.363 -0.835 . . . . 0.0 110.285 -179.624 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.627 HD21 ' ND1' ' A' ' 24' ' ' HIS . 4.2 mp -76.44 170.41 16.42 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.101 -0.999 . . . . 0.0 109.506 179.283 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.479 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.9 t -100.15 -29.4 12.51 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.173 -0.954 . . . . 0.0 111.799 -179.661 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.721 ' HB2' HG11 ' A' ' 20' ' ' VAL . 54.1 m-70 -110.94 146.53 36.43 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.758 -1.214 . . . . 0.0 110.388 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -125.38 93.68 3.93 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.772 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -147.75 176.7 2.08 Favored Pre-proline 0 N--CA 1.496 1.869 0 O-C-N 121.25 -0.906 . . . . 0.0 110.27 -179.611 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 42.5 Cg_endo -69.59 -32.08 19.99 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 O-C-N 123.401 1.211 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 t -86.05 -39.5 16.74 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 120.954 -1.091 . . . . 0.0 109.973 179.5 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.721 HG11 ' HB2' ' A' ' 15' ' ' HIS . 75.7 t -63.38 -47.39 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.208 -0.932 . . . . 0.0 109.595 179.751 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' CZ ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 mtt180 -58.29 -51.64 68.94 Favored 'General case' 0 N--CA 1.511 2.579 0 O-C-N 121.082 -1.011 . . . . 0.0 109.632 179.941 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.6 tttt -62.29 -41.13 98.24 Favored 'General case' 0 N--CA 1.507 2.397 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.789 179.012 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 96.8 m -55.68 -43.17 76.11 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.074 -1.016 . . . . 0.0 108.522 178.324 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.627 ' ND1' HD21 ' A' ' 13' ' ' LEU . 72.3 t60 -61.83 -35.35 77.98 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.644 -0.823 . . . . 0.0 109.288 178.02 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -98.92 44.42 1.03 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.051 -1.03 . . . . 0.0 110.651 -179.795 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m -116.76 39.75 3.11 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.117 -0.989 . . . . 0.0 109.749 179.626 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -128.38 163.54 21.88 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 -179.667 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -89.18 -11.72 42.97 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.281 -1.129 . . . . 0.0 110.842 178.689 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.69 -26.18 19.69 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.729 -1.232 . . . . 0.0 111.087 179.659 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.717 ' O ' HG23 ' A' ' 34' ' ' VAL . 13.1 t-80 -50.67 -39.58 51.37 Favored 'General case' 0 N--CA 1.516 2.858 0 O-C-N 120.737 -1.227 . . . . 0.0 110.546 -179.577 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -64.13 -54.37 34.83 Favored 'General case' 0 N--CA 1.506 2.35 0 C-N-CA 119.296 -0.962 . . . . 0.0 108.945 179.17 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -60.81 -39.53 89.27 Favored 'General case' 0 N--CA 1.508 2.436 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.116 178.588 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -57.2 -38.04 73.09 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.261 -0.899 . . . . 0.0 109.988 179.194 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.728 HG11 HD12 ' A' ' 50' ' ' ILE . 78.9 t -56.81 -37.76 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 O-C-N 121.036 -1.04 . . . . 0.0 109.964 179.703 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.446 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 3.5 ttpp -54.87 -41.24 70.6 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.966 -1.084 . . . . 0.0 109.716 179.435 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.64 -32.0 68.66 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.31 -0.868 . . . . 0.0 110.15 178.963 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -67.66 -52.29 39.74 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.093 -1.004 . . . . 0.0 110.158 179.899 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.64 ' HE1' HG12 ' A' ' 34' ' ' VAL . 44.2 p90 -100.22 33.12 2.75 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.12 -0.987 . . . . 0.0 111.33 179.622 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -79.49 -36.89 37.97 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.755 -1.216 . . . . 0.0 110.144 179.026 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.8 mttt -112.78 31.41 6.4 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.172 -0.955 . . . . 0.0 110.984 179.833 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.446 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.5 t90 -84.33 -38.94 19.75 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.085 -1.01 . . . . 0.0 110.219 179.925 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.446 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -153.72 -65.26 0.15 Allowed 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.121 -0.987 . . . . 0.0 110.674 179.983 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -133.4 -164.64 1.51 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.19 -0.944 . . . . 0.0 110.15 -179.736 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -112.58 39.01 2.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.191 -0.943 . . . . 0.0 110.303 179.877 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -151.17 73.73 1.11 Allowed 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.167 -0.958 . . . . 0.0 110.43 179.874 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -139.11 70.64 1.37 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.219 -0.926 . . . . 0.0 110.217 -179.945 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -114.85 34.56 4.75 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.224 -0.922 . . . . 0.0 110.516 179.646 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.4 m -107.28 -53.05 2.67 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.152 -0.967 . . . . 0.0 109.243 179.184 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.04 -21.37 63.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.244 -0.91 . . . . 0.0 111.225 179.203 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.728 HD12 HG11 ' A' ' 34' ' ' VAL . 49.9 mm -77.56 -54.87 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.604 -1.31 . . . . 0.0 109.534 179.603 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.447 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 23.0 t70 -60.61 -40.97 93.8 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.798 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.799 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 25.9 mmtt -58.69 -35.82 73.24 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.175 -0.953 . . . . 0.0 110.333 179.782 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 82.7 m -84.85 -36.04 21.84 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.995 -1.065 . . . . 0.0 110.308 179.717 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.447 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.8 p -74.76 -35.39 62.58 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.046 -1.034 . . . . 0.0 110.559 179.812 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.02 -39.51 12.16 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.046 -1.033 . . . . 0.0 110.295 179.953 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.799 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -94.83 54.65 1.76 Allowed 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.122 -0.986 . . . . 0.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -92.85 -39.52 11.14 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.154 -0.967 . . . . 0.0 110.086 179.586 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -134.04 77.11 1.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.165 -0.959 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.03 -63.13 1.5 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.118 -0.989 . . . . 0.0 110.234 179.906 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 138.84 109.54 0.87 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.86 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.14 -1.212 . . . . 0.0 110.175 179.889 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mtt . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.72 144.65 39.79 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.399 1.21 . . . . 0.0 110.217 179.875 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.461 ' HB3' ' CE1' ' A' ' 12' ' ' TYR . 16.2 mtmm 55.39 99.52 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.07 -1.019 . . . . 0.0 110.374 -179.859 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.462 ' CD1' HD13 ' A' ' 13' ' ' LEU . 63.7 t80 -54.0 159.16 1.86 Allowed 'General case' 0 N--CA 1.512 2.662 0 O-C-N 121.083 -1.01 . . . . 0.0 111.049 -179.493 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -141.71 130.91 23.43 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.306 -0.871 . . . . 0.0 109.51 179.887 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.5 t -113.39 92.36 3.97 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.095 -1.003 . . . . 0.0 110.449 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -53.57 -35.69 61.07 Favored 'General case' 0 N--CA 1.512 2.649 0 O-C-N 121.024 -1.048 . . . . 0.0 110.233 179.482 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 34' ' ' VAL . 86.0 m-85 -59.75 -35.42 74.54 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.134 -0.979 . . . . 0.0 109.975 179.182 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 34.3 m -93.54 1.08 56.85 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.186 -0.946 . . . . 0.0 112.075 179.971 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t70 52.1 38.34 23.92 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 120.453 -1.404 . . . . 0.0 110.749 -179.843 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 t -141.17 168.42 19.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.203 -0.936 . . . . 0.0 110.147 179.908 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.461 ' CE1' ' HB3' ' A' ' 3' ' ' LYS . 33.0 t80 -122.84 133.0 54.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.302 -0.874 . . . . 0.0 110.307 -179.739 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.517 HD12 ' N ' ' A' ' 13' ' ' LEU . 6.1 mp -89.23 163.85 15.22 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.11 -0.994 . . . . 0.0 109.721 179.591 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -99.56 -30.81 11.93 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.081 -1.012 . . . . 0.0 111.668 -179.466 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 44.1 m-70 -114.85 136.1 53.46 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.79 -1.194 . . . . 0.0 110.231 -179.858 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -112.92 92.85 4.16 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.219 -0.926 . . . . 0.0 109.826 179.75 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' PRO . 0.1 OUTLIER -138.85 178.77 1.51 Allowed Pre-proline 0 N--CA 1.494 1.732 0 O-C-N 121.248 -0.908 . . . . 0.0 109.969 -179.715 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 43.1 Cg_endo -70.62 -29.58 19.54 Favored 'Trans proline' 0 C--N 1.316 -1.169 0 O-C-N 123.377 1.199 . . . . 0.0 111.137 -179.91 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 t -88.91 -43.56 11.09 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 120.948 -1.095 . . . . 0.0 109.936 179.538 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.407 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -59.83 -52.65 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.576 0 O-C-N 121.129 -0.982 . . . . 0.0 109.762 179.756 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.433 ' HG2' ' CG ' ' A' ' 4' ' ' PHE . 31.2 mtp-105 -58.03 -49.9 75.27 Favored 'General case' 0 N--CA 1.511 2.592 0 O-C-N 121.122 -0.986 . . . . 0.0 109.546 179.784 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -61.54 -40.35 94.35 Favored 'General case' 0 N--CA 1.508 2.433 0 C-N-CA 119.348 -0.941 . . . . 0.0 108.841 178.689 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 65.1 m -54.25 -42.71 70.21 Favored 'General case' 0 N--CA 1.512 2.629 0 O-C-N 121.105 -0.997 . . . . 0.0 108.639 178.407 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -63.14 -38.65 92.0 Favored 'General case' 0 N--CA 1.503 2.218 0 C-N-CA 119.606 -0.838 . . . . 0.0 109.075 178.198 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.8 t -95.2 53.4 1.52 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.221 -0.924 . . . . 0.0 110.457 -179.702 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.79 40.28 2.82 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.168 -0.957 . . . . 0.0 109.782 179.618 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -139.21 147.41 19.19 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.844 -1.303 . . . . 0.0 109.844 -179.74 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 71.7 ttt-85 -79.93 -10.36 59.77 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.224 -1.163 . . . . 0.0 111.047 178.864 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -90.54 -19.36 23.86 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 120.632 -1.293 . . . . 0.0 111.467 179.657 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.417 ' O ' HG23 ' A' ' 34' ' ' VAL . 24.6 t-80 -48.63 -40.32 27.26 Favored 'General case' 0 N--CA 1.517 2.925 0 O-C-N 120.681 -1.262 . . . . 0.0 110.907 -179.758 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.15 -52.81 57.25 Favored 'General case' 0 N--CA 1.507 2.385 0 C-N-CA 119.27 -0.972 . . . . 0.0 108.743 179.118 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -61.29 -38.93 88.56 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.235 -0.915 . . . . 0.0 108.987 178.452 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -55.43 -37.79 68.14 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.193 -0.942 . . . . 0.0 110.038 179.209 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 8' ' ' TYR . 60.9 t -57.87 -37.49 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.605 0 O-C-N 121.139 -0.976 . . . . 0.0 109.788 179.576 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 27.3 tttt -54.42 -41.11 68.96 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 120.874 -1.141 . . . . 0.0 109.763 179.38 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -58.5 -27.95 64.94 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.569 -0.852 . . . . 0.0 110.366 178.961 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -71.35 -53.02 15.56 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 120.897 -1.127 . . . . 0.0 110.089 179.983 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 35.5 p90 -99.85 33.68 2.49 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.151 -0.968 . . . . 0.0 111.256 179.624 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -81.67 -37.25 27.73 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.767 -1.208 . . . . 0.0 110.145 179.027 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -100.06 20.92 13.58 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.195 -0.941 . . . . 0.0 111.212 179.332 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.623 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 15.0 t90 -102.6 -48.62 4.07 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.837 -1.165 . . . . 0.0 109.951 179.77 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.623 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -124.98 -58.13 1.48 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.24 -0.912 . . . . 0.0 109.997 179.725 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 54.0 38.73 29.51 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.922 -1.111 . . . . 0.0 110.822 179.998 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -145.87 -61.38 0.33 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.169 -0.957 . . . . 0.0 110.156 179.863 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -151.24 74.91 1.16 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.158 -0.964 . . . . 0.0 110.459 179.845 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.25 71.36 1.29 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.193 -0.942 . . . . 0.0 110.469 -179.824 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -123.32 32.33 5.69 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.223 -0.923 . . . . 0.0 110.689 179.364 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.02 -48.25 3.94 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.082 -1.011 . . . . 0.0 109.687 179.271 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.56 -21.23 62.33 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.197 -0.94 . . . . 0.0 111.492 179.342 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.716 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -80.85 -40.2 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 O-C-N 120.666 -1.272 . . . . 0.0 110.001 179.861 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.443 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 2.0 t70 -80.43 -40.98 25.32 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.194 -0.941 . . . . 0.0 109.897 179.791 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.34 -33.27 69.34 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.21 -0.931 . . . . 0.0 110.558 179.751 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.7 m -90.38 -38.32 13.4 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 120.944 -1.097 . . . . 0.0 110.489 -179.982 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 50' ' ' ILE . 33.8 p -69.31 -37.35 77.74 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.087 -1.008 . . . . 0.0 110.379 179.856 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.51 -40.62 63.92 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.043 -1.036 . . . . 0.0 110.015 179.982 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.43 50.54 1.15 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.126 -0.984 . . . . 0.0 110.596 179.606 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -93.15 -39.23 11.15 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.15 -0.969 . . . . 0.0 110.328 179.828 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -115.79 -59.69 1.96 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.207 -0.933 . . . . 0.0 110.356 -179.859 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -136.67 -59.0 0.73 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.197 -0.94 . . . . 0.0 110.43 -179.848 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 61.31 83.25 0.06 OUTLIER Glycine 0 N--CA 1.495 2.612 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.943 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.7 ttpp . . . . . 0 N--CA 1.494 1.747 0 O-C-N 121.214 -1.168 . . . . 0.0 110.231 -179.983 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.61 122.84 8.58 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.417 1.219 . . . . 0.0 110.399 179.969 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.446 ' HB3' ' CE2' ' A' ' 12' ' ' TYR . 15.8 mmtt -124.19 162.05 24.46 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.196 -0.94 . . . . 0.0 110.054 -179.956 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.488 ' HD1' HD13 ' A' ' 13' ' ' LEU . 76.0 t80 -114.57 161.89 17.46 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.992 179.689 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -142.78 131.34 22.45 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.251 -0.906 . . . . 0.0 110.223 -179.457 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 33.7 t -108.08 92.25 3.99 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.132 -0.98 . . . . 0.0 110.012 179.339 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -51.44 -35.54 39.95 Favored 'General case' 0 N--CA 1.515 2.824 0 O-C-N 121.151 -0.968 . . . . 0.0 110.539 -179.989 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.888 ' CD2' HG13 ' A' ' 34' ' ' VAL . 79.6 m-85 -61.62 -31.04 71.1 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.059 -1.025 . . . . 0.0 110.144 179.068 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 48.4 m -100.8 -4.21 28.43 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.936 -1.102 . . . . 0.0 112.334 -179.856 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 t70 54.21 38.68 29.73 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.347 -1.471 . . . . 0.0 110.453 -179.614 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 t -137.03 169.78 17.2 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.218 -0.926 . . . . 0.0 109.745 179.785 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.446 ' CE2' ' HB3' ' A' ' 3' ' ' LYS . 13.9 t80 -119.34 139.54 51.8 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.207 -0.933 . . . . 0.0 110.641 -179.549 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.488 HD13 ' HD1' ' A' ' 4' ' ' PHE . 3.9 mp -104.01 155.83 18.35 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.287 -0.883 . . . . 0.0 109.471 179.396 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.49 HG23 ' CD2' ' A' ' 15' ' ' HIS . 13.4 t -103.56 -29.43 11.14 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.076 -1.015 . . . . 0.0 112.293 -179.122 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.506 ' CB ' HG21 ' A' ' 20' ' ' VAL . 57.6 m-70 -109.62 86.53 2.31 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.778 -1.201 . . . . 0.0 110.481 -179.734 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -73.78 71.08 1.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.24 -0.913 . . . . 0.0 110.169 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.413 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 1.0 OUTLIER -114.45 179.77 0.73 Allowed Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 109.934 179.965 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.413 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.9 Cg_endo -71.7 -31.35 13.32 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.292 1.154 . . . . 0.0 111.067 -179.915 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 58.5 m -85.53 -46.49 10.79 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.943 -1.098 . . . . 0.0 109.832 179.58 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' A' ' 15' ' ' HIS . 84.6 t -59.06 -52.26 62.86 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.642 0 O-C-N 121.089 -1.007 . . . . 0.0 109.719 179.802 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 4' ' ' PHE . 3.1 mtt180 -56.7 -51.44 68.8 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.097 -1.002 . . . . 0.0 109.696 179.842 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -61.6 -40.49 95.0 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.338 -0.945 . . . . 0.0 108.766 178.816 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 99.0 m -55.16 -43.43 74.27 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 121.056 -1.027 . . . . 0.0 108.408 178.273 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.592 -0.843 . . . . 0.0 109.029 178.052 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t -97.8 47.53 1.01 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.241 -0.912 . . . . 0.0 110.513 -179.697 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 3.2 m -116.21 40.23 2.9 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.139 -0.976 . . . . 0.0 109.815 179.493 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -135.11 150.36 20.16 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -179.705 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 9.2 ttt85 -81.14 -10.04 59.71 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.232 -1.157 . . . . 0.0 111.031 178.844 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.9 mttp -90.46 -21.55 21.82 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.7 -1.25 . . . . 0.0 111.408 179.602 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 34' ' ' VAL . 18.2 t-80 -48.33 -37.55 16.85 Favored 'General case' 0 N--CA 1.518 2.97 0 O-C-N 120.806 -1.184 . . . . 0.0 110.998 -179.735 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -63.79 -54.44 35.08 Favored 'General case' 0 N--CA 1.507 2.419 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.944 179.175 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -60.4 -39.47 87.45 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.273 -0.892 . . . . 0.0 108.968 178.748 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -55.68 -37.41 68.29 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.224 -0.923 . . . . 0.0 110.11 179.158 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.888 HG13 ' CD2' ' A' ' 8' ' ' TYR . 53.0 t -55.67 -35.34 38.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.569 0 O-C-N 121.015 -1.053 . . . . 0.0 110.222 179.74 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 62.8 tttt -53.1 -41.33 64.85 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.876 -1.14 . . . . 0.0 110.025 179.659 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.67 -28.91 66.18 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.296 -0.877 . . . . 0.0 110.382 178.952 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -68.45 -51.75 40.22 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 120.895 -1.128 . . . . 0.0 110.368 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.449 ' CE1' ' HA ' ' A' ' 35' ' ' LYS . 45.1 p90 -100.07 35.55 2.04 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.016 -1.053 . . . . 0.0 111.196 179.753 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.2 -39.23 12.94 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.88 -1.138 . . . . 0.0 109.843 178.72 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -111.65 31.01 6.47 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.297 -0.877 . . . . 0.0 110.639 179.378 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.43 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 23.3 t90 -94.62 -40.26 9.92 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.082 -1.011 . . . . 0.0 110.152 -179.901 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.43 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.4 ttm -148.47 -63.89 0.25 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.176 -0.953 . . . . 0.0 110.359 179.954 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -146.79 -164.56 2.02 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.119 -0.988 . . . . 0.0 110.199 -179.908 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -111.39 39.76 2.24 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.137 -0.977 . . . . 0.0 110.143 179.884 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -144.54 74.45 1.42 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.233 -0.917 . . . . 0.0 110.216 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -145.44 71.81 1.3 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.194 -0.941 . . . . 0.0 110.355 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -114.7 35.02 4.45 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.22 -0.925 . . . . 0.0 110.493 179.663 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.2 p -108.37 -53.12 2.67 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.084 -1.01 . . . . 0.0 109.419 179.315 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -20.68 63.98 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.154 -0.966 . . . . 0.0 111.35 179.39 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.792 HD12 HG11 ' A' ' 34' ' ' VAL . 49.6 mm -74.82 -44.08 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.377 0 O-C-N 120.557 -1.339 . . . . 0.0 109.685 179.791 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.84 -41.46 95.86 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.193 -0.942 . . . . 0.0 109.826 -179.969 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.2 tmtt? -59.8 -36.22 76.31 Favored 'General case' 0 N--CA 1.51 2.542 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.262 179.872 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 m -87.65 -36.96 17.16 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.058 -1.026 . . . . 0.0 110.329 179.743 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.49 HG23 ' O ' ' A' ' 50' ' ' ILE . 82.7 p -75.31 -40.33 58.62 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.062 -1.024 . . . . 0.0 109.882 179.729 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.99 -34.44 56.09 Favored 'General case' 0 N--CA 1.512 2.645 0 O-C-N 121.023 -1.048 . . . . 0.0 110.88 179.901 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -85.72 -35.91 20.52 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.06 -1.025 . . . . 0.0 110.419 179.865 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -92.14 11.61 24.95 Favored 'General case' 0 N--CA 1.507 2.375 0 O-C-N 120.999 -1.063 . . . . 0.0 111.978 179.703 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -131.38 76.28 1.71 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.614 -1.303 . . . . 0.0 110.076 179.797 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -113.27 50.76 0.87 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.167 -0.958 . . . . 0.0 110.226 179.99 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -91.96 -74.3 1.27 Allowed Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 179.949 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 23.6 tttm . . . . . 0 N--CA 1.494 1.739 0 O-C-N 121.154 -1.204 . . . . 0.0 110.267 179.995 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mtt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.92 162.28 41.45 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 O-C-N 123.416 1.219 . . . . 0.0 110.385 -179.979 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.9 mttm 55.77 169.88 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.311 -0.868 . . . . 0.0 110.78 -179.983 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.598 ' HD1' HD13 ' A' ' 13' ' ' LEU . 57.4 t80 -130.51 162.28 29.58 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.048 -1.033 . . . . 0.0 110.013 -179.683 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.423 ' N ' ' CD1' ' A' ' 4' ' ' PHE . 33.4 t80 -135.52 132.65 37.55 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.177 -0.952 . . . . 0.0 110.532 -179.583 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 20.7 t -110.65 90.09 3.23 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.214 -0.929 . . . . 0.0 109.633 179.248 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -50.06 -34.92 23.17 Favored 'General case' 0 N--CA 1.514 2.758 0 O-C-N 121.131 -0.981 . . . . 0.0 111.197 -179.603 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.927 ' CD1' HG13 ' A' ' 34' ' ' VAL . 25.2 m-85 -64.17 -32.24 73.74 Favored 'General case' 0 N--CA 1.511 2.616 0 C-N-CA 119.269 -0.972 . . . . 0.0 109.848 179.526 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 43.7 m -95.98 -6.36 39.08 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.971 -1.081 . . . . 0.0 112.041 179.696 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 t70 55.81 39.68 30.71 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 120.447 -1.408 . . . . 0.0 110.352 -179.456 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.0 t -140.24 169.68 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.171 -0.956 . . . . 0.0 109.79 179.82 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -120.55 144.56 48.01 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.148 -0.97 . . . . 0.0 110.563 -179.685 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.598 HD13 ' HD1' ' A' ' 4' ' ' PHE . 6.4 mp -102.97 166.42 10.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.16 -0.962 . . . . 0.0 109.771 179.543 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.521 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.0 t -104.41 -29.96 10.38 Favored 'General case' 0 N--CA 1.504 2.257 0 O-C-N 121.103 -0.998 . . . . 0.0 112.285 -179.17 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.74 ' O ' HG11 ' A' ' 20' ' ' VAL . 51.2 m-70 -112.68 124.19 52.0 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 120.7 -1.25 . . . . 0.0 110.451 -179.577 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -98.69 64.95 1.53 Allowed 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.107 -0.996 . . . . 0.0 110.408 179.907 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -113.78 178.36 0.98 Allowed Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 121.214 -0.929 . . . . 0.0 109.96 179.825 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -72.07 -35.94 6.44 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.359 1.189 . . . . 0.0 110.736 -179.939 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.3 t -76.23 -39.54 54.27 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.063 -1.023 . . . . 0.0 110.011 179.711 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.74 HG11 ' O ' ' A' ' 15' ' ' HIS . 98.6 t -58.94 -54.53 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.563 0 O-C-N 121.112 -0.993 . . . . 0.0 109.856 179.923 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.6 mtp180 -55.37 -50.85 68.63 Favored 'General case' 0 N--CA 1.512 2.632 0 O-C-N 121.054 -1.029 . . . . 0.0 109.793 179.946 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -62.0 -40.85 97.06 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.328 -0.949 . . . . 0.0 108.797 178.77 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 86.3 m -56.43 -44.17 80.16 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.082 -1.011 . . . . 0.0 108.318 178.324 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -63.21 -38.29 90.6 Favored 'General case' 0 N--CA 1.503 2.192 0 C-N-CA 119.66 -0.816 . . . . 0.0 108.869 178.11 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.9 t -94.34 55.1 1.95 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.307 -0.871 . . . . 0.0 110.206 -179.988 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -114.85 39.84 2.76 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.106 -0.996 . . . . 0.0 110.005 179.759 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -138.52 152.14 21.89 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.1 ttm105 -81.22 -11.96 59.27 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.238 -1.154 . . . . 0.0 111.183 179.053 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -90.99 -20.92 21.59 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.694 -1.254 . . . . 0.0 111.456 179.704 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.556 ' O ' HG23 ' A' ' 34' ' ' VAL . 23.7 t-80 -49.0 -42.39 37.73 Favored 'General case' 0 N--CA 1.518 2.929 0 O-C-N 120.715 -1.24 . . . . 0.0 111.007 -179.627 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 mtmt -62.52 -55.05 31.08 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.129 -0.982 . . . . 0.0 109.019 179.356 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -60.08 -38.48 83.03 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.15 178.612 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -57.08 -39.65 75.39 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.274 -0.891 . . . . 0.0 109.935 179.359 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.927 HG13 ' CD1' ' A' ' 8' ' ' TYR . 96.9 t -62.71 -36.2 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.174 -0.954 . . . . 0.0 109.823 179.476 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.448 ' HA ' ' CE2' ' A' ' 38' ' ' TYR . 15.2 ttpp -52.33 -39.86 61.2 Favored 'General case' 0 N--CA 1.514 2.77 0 O-C-N 120.998 -1.064 . . . . 0.0 110.079 179.444 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -58.64 -32.13 68.77 Favored 'General case' 0 N--CA 1.506 2.358 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.195 178.985 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -66.65 -52.42 45.12 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.86 -1.15 . . . . 0.0 110.144 179.933 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 47.4 p90 -100.1 33.59 2.58 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.087 -1.008 . . . . 0.0 111.297 179.592 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.41 -36.41 39.13 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 120.783 -1.198 . . . . 0.0 110.163 179.006 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.2 tptt -111.13 30.05 7.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.16 -0.963 . . . . 0.0 110.969 179.701 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.501 ' CD2' ' HE2' ' A' ' 42' ' ' MET . 26.2 t90 -92.53 -39.79 11.17 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.119 -0.988 . . . . 0.0 110.124 179.888 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.501 ' HE2' ' CD2' ' A' ' 41' ' ' TRP . 7.6 tpp -143.65 -59.95 0.4 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.115 -0.991 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -151.99 -170.32 3.61 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.211 -0.93 . . . . 0.0 110.392 -179.803 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -106.29 52.77 0.72 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.1 -1.0 . . . . 0.0 110.157 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -166.36 73.47 0.16 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.187 -0.945 . . . . 0.0 110.775 179.962 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.405 ' O ' ' CE1' ' A' ' 38' ' ' TYR . . . -146.14 72.07 1.28 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.266 -0.897 . . . . 0.0 110.265 -179.926 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -110.93 36.08 3.28 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.238 -0.914 . . . . 0.0 110.32 179.573 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.5 t -110.4 -54.07 2.62 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.151 -0.968 . . . . 0.0 109.617 179.436 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.87 -21.41 63.25 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.244 -0.91 . . . . 0.0 111.458 179.508 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.777 HD12 HG11 ' A' ' 34' ' ' VAL . 46.7 mm -70.5 -40.86 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 120.569 -1.332 . . . . 0.0 109.672 179.651 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.15 -34.83 79.31 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.147 -0.971 . . . . 0.0 110.474 179.838 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -90.08 -39.36 12.94 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.034 -1.041 . . . . 0.0 110.403 179.895 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 85.3 m -64.87 -39.07 92.96 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.13 -0.981 . . . . 0.0 110.005 179.897 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.541 HG23 ' O ' ' A' ' 50' ' ' ILE . 16.7 p -56.93 -38.15 72.48 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 121.064 -1.023 . . . . 0.0 110.46 179.964 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.15 -40.4 11.04 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.13 -0.981 . . . . 0.0 110.222 179.849 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.65 52.93 1.39 Allowed 'General case' 0 N--CA 1.504 2.254 0 O-C-N 121.14 -0.975 . . . . 0.0 110.521 179.74 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -92.74 -44.41 8.55 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.246 -0.909 . . . . 0.0 110.118 179.686 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -117.64 -64.39 1.31 Allowed 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.201 -0.937 . . . . 0.0 110.184 -179.999 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -138.56 78.89 1.7 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.192 179.964 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -93.0 -76.47 1.34 Allowed Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.987 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.782 0 O-C-N 121.21 -1.171 . . . . 0.0 110.139 -179.93 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 mmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.86 166.61 29.51 Favored 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.403 1.212 . . . . 0.0 110.377 -179.913 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.447 ' HB2' ' CZ ' ' A' ' 12' ' ' TYR . 46.9 mttt -131.66 157.73 42.94 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.228 -0.92 . . . . 0.0 110.197 179.969 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.656 ' HD2' HD13 ' A' ' 13' ' ' LEU . 91.0 t80 -112.4 161.9 16.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.205 -0.934 . . . . 0.0 110.052 -179.9 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -131.28 138.28 49.21 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.165 -0.96 . . . . 0.0 110.401 -179.719 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 46.5 t -116.83 96.95 5.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.156 -0.965 . . . . 0.0 109.955 179.46 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -51.53 -35.63 41.47 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 121.014 -1.054 . . . . 0.0 110.658 -179.991 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.669 ' CD2' HG13 ' A' ' 34' ' ' VAL . 81.8 m-85 -63.14 -31.07 72.12 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.132 -0.98 . . . . 0.0 110.202 179.252 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 51.7 m -100.07 -10.14 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.972 -1.08 . . . . 0.0 112.055 -179.939 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t0 56.39 40.76 29.6 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.405 -1.434 . . . . 0.0 110.167 -179.464 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 t -141.76 172.49 12.61 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.221 -0.924 . . . . 0.0 109.985 179.944 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.447 ' CZ ' ' HB2' ' A' ' 3' ' ' LYS . 5.0 t80 -119.96 135.1 55.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.17 -0.956 . . . . 0.0 110.575 -179.72 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.656 HD13 ' HD2' ' A' ' 4' ' ' PHE . 5.7 mp -91.48 170.28 10.08 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.234 -0.916 . . . . 0.0 109.687 179.537 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.514 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.7 t -97.58 -31.68 12.19 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.175 -0.953 . . . . 0.0 111.388 -179.717 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.514 ' CD2' HG23 ' A' ' 14' ' ' THR . 39.3 m-70 -116.05 135.86 53.56 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.849 -1.157 . . . . 0.0 110.125 179.989 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -114.01 95.85 5.52 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.149 -0.969 . . . . 0.0 109.882 179.822 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.401 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -144.73 177.74 1.68 Allowed Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.253 -0.905 . . . . 0.0 110.247 -179.603 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 43.7 Cg_endo -70.5 -32.15 16.01 Favored 'Trans proline' 0 C--N 1.316 -1.17 0 O-C-N 123.398 1.209 . . . . 0.0 110.969 179.824 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 26.8 m -85.11 -40.26 16.97 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.933 -1.105 . . . . 0.0 109.979 179.562 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 15' ' ' HIS . 92.5 t -63.18 -49.52 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.467 0 O-C-N 121.135 -0.978 . . . . 0.0 109.688 179.793 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 63.6 mtm-85 -55.93 -52.14 65.16 Favored 'General case' 0 N--CA 1.511 2.615 0 O-C-N 121.061 -1.024 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.5 mtpt -61.15 -40.28 93.26 Favored 'General case' 0 N--CA 1.509 2.48 0 C-N-CA 119.287 -0.965 . . . . 0.0 108.883 178.811 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 98.9 m -55.49 -43.44 75.61 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 121.085 -1.009 . . . . 0.0 108.368 178.345 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -62.17 -38.8 90.42 Favored 'General case' 0 N--CA 1.504 2.227 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 177.974 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.5 t -95.83 52.34 1.32 Allowed 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.218 -0.926 . . . . 0.0 110.373 -179.89 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m -120.0 37.36 4.24 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.094 -1.003 . . . . 0.0 110.256 179.775 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -143.07 128.53 3.45 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.948 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.8 ttp180 -54.03 -28.89 41.2 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.168 -1.195 . . . . 0.0 110.423 179.199 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.6 tttp -59.75 -35.39 74.49 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 120.958 -1.089 . . . . 0.0 110.352 179.906 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.554 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.3 t-80 -51.25 -38.98 55.66 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.925 -1.11 . . . . 0.0 110.61 -179.611 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -62.18 -55.42 28.8 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.164 -0.96 . . . . 0.0 109.131 179.381 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -59.36 -39.45 83.32 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.249 -0.907 . . . . 0.0 109.124 178.766 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -56.44 -38.39 71.55 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.317 -0.864 . . . . 0.0 109.97 179.252 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.791 HG11 HD12 ' A' ' 50' ' ' ILE . 72.3 t -58.92 -37.11 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.15 -0.969 . . . . 0.0 109.952 179.743 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 31.2 mtmt -53.37 -41.46 65.87 Favored 'General case' 0 N--CA 1.513 2.721 0 O-C-N 120.969 -1.082 . . . . 0.0 109.863 179.768 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -58.38 -32.37 68.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.311 -0.868 . . . . 0.0 110.152 178.891 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -63.48 -51.31 66.13 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.027 -1.046 . . . . 0.0 110.151 179.935 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.585 ' HE1' HG12 ' A' ' 34' ' ' VAL . 47.7 p90 -100.66 36.27 1.96 Allowed 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.09 -1.006 . . . . 0.0 111.151 179.62 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -89.15 -37.79 14.78 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 120.882 -1.137 . . . . 0.0 110.131 178.887 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.96 27.96 9.07 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.194 -0.941 . . . . 0.0 111.014 179.568 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.435 ' CD2' ' HE3' ' A' ' 42' ' ' MET . 23.0 t90 -92.81 -40.49 10.62 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.989 -1.069 . . . . 0.0 110.198 179.921 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.435 ' HE3' ' CD2' ' A' ' 41' ' ' TRP . 2.4 ttm -149.18 -63.84 0.23 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.097 -1.002 . . . . 0.0 110.502 179.954 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.54 2.18 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.207 -0.933 . . . . 0.0 110.137 179.996 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -109.8 39.42 2.13 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.132 -0.98 . . . . 0.0 110.259 179.787 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tp60 -148.45 75.69 1.33 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.157 -0.964 . . . . 0.0 110.299 179.885 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.511 ' HB3' ' CD2' ' A' ' 38' ' ' TYR . . . -136.9 74.67 1.5 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.294 -0.879 . . . . 0.0 110.251 -179.836 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.91 35.01 3.68 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.173 -0.955 . . . . 0.0 110.46 179.611 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.3 p -109.16 -54.75 2.5 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.084 -1.01 . . . . 0.0 109.189 179.152 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.73 -20.51 65.0 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.283 -0.885 . . . . 0.0 111.175 179.154 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.791 HD12 HG11 ' A' ' 34' ' ' VAL . 49.7 mm -75.24 -40.22 43.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.353 0 O-C-N 120.67 -1.269 . . . . 0.0 109.837 179.778 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.418 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 0.8 OUTLIER -70.57 -40.42 73.33 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.175 -0.953 . . . . 0.0 109.957 179.942 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.747 ' O ' ' HB3' ' A' ' 56' ' ' ALA . 13.7 tttp -58.2 -35.66 71.97 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.252 -0.905 . . . . 0.0 110.488 179.967 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.0 m -90.7 -48.08 7.27 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.091 -1.006 . . . . 0.0 110.155 179.848 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 50' ' ' ILE . 64.4 p -57.38 -34.73 69.16 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 121.206 -0.934 . . . . 0.0 110.553 179.91 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -90.36 -40.13 12.27 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.035 -1.041 . . . . 0.0 110.107 179.734 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.747 ' HB3' ' O ' ' A' ' 52' ' ' LYS . . . -97.13 48.36 1.05 Allowed 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.13 -0.981 . . . . 0.0 110.629 179.617 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.63 -42.86 9.41 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.074 -1.016 . . . . 0.0 110.258 179.724 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -131.86 74.8 1.61 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.177 -0.952 . . . . 0.0 110.499 179.946 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -113.82 -55.92 2.45 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.134 -0.979 . . . . 0.0 110.214 179.794 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 116.62 -56.01 0.54 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.898 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.5 mttp . . . . . 0 N--CA 1.494 1.758 0 O-C-N 121.219 -1.165 . . . . 0.0 110.181 179.987 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mtm . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 110.241 -0.281 . . . . 0.0 110.241 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.59 151.83 53.09 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.474 1.249 . . . . 0.0 110.368 179.992 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.9 mtmt -125.49 155.41 40.57 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.234 -0.916 . . . . 0.0 110.037 -179.884 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.595 ' HD2' HD13 ' A' ' 13' ' ' LEU . 87.1 t80 -113.31 161.77 16.84 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.065 -1.022 . . . . 0.0 109.998 179.93 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -137.76 133.66 34.36 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.272 -0.892 . . . . 0.0 110.278 -179.687 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 26.3 t -114.45 98.18 6.75 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.201 -0.937 . . . . 0.0 109.718 179.382 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -56.32 -36.96 69.31 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.101 -0.999 . . . . 0.0 110.758 -179.434 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.966 ' CD1' HG13 ' A' ' 34' ' ' VAL . 27.8 m-85 -61.93 -32.66 73.08 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.953 -1.092 . . . . 0.0 110.169 179.555 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 41.8 m -93.31 -6.15 48.07 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.95 -1.094 . . . . 0.0 111.897 179.456 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.3 t70 54.71 39.48 31.34 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 120.443 -1.41 . . . . 0.0 110.437 -179.688 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 t -142.12 168.08 20.59 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.253 -0.905 . . . . 0.0 109.895 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -118.23 139.99 50.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.178 -0.952 . . . . 0.0 110.571 -179.706 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.595 HD13 ' HD2' ' A' ' 4' ' ' PHE . 4.9 mp -97.62 166.3 11.56 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.24 -0.912 . . . . 0.0 109.657 179.565 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.511 HG23 ' CD2' ' A' ' 15' ' ' HIS . 14.4 t -100.91 -30.63 11.55 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.128 -0.983 . . . . 0.0 111.881 -179.452 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.511 ' CD2' HG23 ' A' ' 14' ' ' THR . 35.9 m-70 -118.11 134.98 54.5 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.799 -1.188 . . . . 0.0 110.226 -179.871 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -112.3 96.73 6.18 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.198 -0.939 . . . . 0.0 109.818 179.685 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.403 ' CB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -142.52 177.9 1.69 Allowed Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 -179.568 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.403 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 42.8 Cg_endo -69.87 -29.95 22.54 Favored 'Trans proline' 0 C--N 1.316 -1.175 0 O-C-N 123.416 1.219 . . . . 0.0 111.039 179.827 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 t -88.72 -44.04 10.85 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.927 -1.108 . . . . 0.0 109.867 179.396 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.405 HG11 ' O ' ' A' ' 15' ' ' HIS . 89.7 t -61.2 -48.96 86.58 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.562 0 O-C-N 121.196 -0.94 . . . . 0.0 109.468 179.574 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -59.15 -50.65 73.22 Favored 'General case' 0 N--CA 1.511 2.594 0 O-C-N 121.108 -0.995 . . . . 0.0 109.25 179.541 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -61.7 -40.37 94.79 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.2 -0.937 . . . . 0.0 108.788 178.7 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 88.2 m -54.66 -43.57 72.52 Favored 'General case' 0 N--CA 1.51 2.565 0 O-C-N 121.042 -1.036 . . . . 0.0 108.455 178.292 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -63.38 -40.36 97.04 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.949 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.6 t -94.36 55.7 2.03 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.29 -0.881 . . . . 0.0 110.097 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -115.95 37.5 3.63 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.18 -0.95 . . . . 0.0 110.432 179.937 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -148.08 125.62 2.14 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.825 -1.31 . . . . 0.0 109.825 -179.952 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.7 ttp85 -54.28 -28.34 41.32 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 121.207 -1.172 . . . . 0.0 110.436 179.157 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -61.22 -31.57 71.35 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 120.949 -1.094 . . . . 0.0 110.626 179.882 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.708 ' O ' HG23 ' A' ' 34' ' ' VAL . 17.8 t-80 -49.35 -38.82 29.54 Favored 'General case' 0 N--CA 1.515 2.782 0 O-C-N 120.903 -1.123 . . . . 0.0 110.937 -179.503 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.4 tttp -63.73 -55.2 25.02 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.101 -1.0 . . . . 0.0 109.039 179.339 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -60.33 -38.99 85.46 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.419 -0.912 . . . . 0.0 109.136 178.682 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -57.16 -36.81 71.22 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.215 -0.928 . . . . 0.0 110.222 179.27 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.966 HG13 ' CD1' ' A' ' 8' ' ' TYR . 97.3 t -58.04 -38.69 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 121.069 -1.019 . . . . 0.0 109.908 179.898 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 38' ' ' TYR . 11.3 mttt -58.59 -42.09 87.3 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.009 -1.057 . . . . 0.0 109.454 179.227 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -59.48 -31.15 69.08 Favored 'General case' 0 N--CA 1.506 2.342 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.035 178.805 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.429 ' CG ' ' HA ' ' A' ' 8' ' ' TYR . 51.2 t80 -67.36 -51.54 50.92 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.012 -1.055 . . . . 0.0 110.346 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.714 ' HE1' HG12 ' A' ' 34' ' ' VAL . 42.4 p90 -99.25 29.84 3.76 Favored 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.036 -1.04 . . . . 0.0 111.695 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -78.37 -39.75 38.34 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 120.652 -1.28 . . . . 0.0 109.732 178.666 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -115.36 36.87 3.74 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.313 -0.867 . . . . 0.0 110.217 179.41 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.441 ' CE2' ' CE ' ' A' ' 42' ' ' MET . 21.9 t90 -92.26 -38.5 12.05 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.175 -0.953 . . . . 0.0 110.19 -179.771 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.441 ' CE ' ' CE2' ' A' ' 41' ' ' TRP . 2.5 ttm -147.11 -65.51 0.27 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.16 -0.962 . . . . 0.0 110.347 179.89 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -145.89 -163.11 1.66 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.205 -0.934 . . . . 0.0 110.152 -179.878 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -103.66 -177.5 3.39 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.104 -0.998 . . . . 0.0 110.073 179.791 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 53.28 74.54 0.3 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.025 -1.047 . . . . 0.0 110.608 -179.743 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -136.41 70.15 1.42 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.247 -0.908 . . . . 0.0 110.166 -179.967 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -115.64 33.61 5.38 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.254 -0.904 . . . . 0.0 110.629 179.595 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.96 -53.04 2.74 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.022 -1.049 . . . . 0.0 109.009 179.032 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.8 -20.54 65.12 Favored 'General case' 0 N--CA 1.507 2.403 0 O-C-N 121.331 -0.855 . . . . 0.0 111.181 178.943 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.722 HD12 HG11 ' A' ' 34' ' ' VAL . 50.9 mm -81.53 -55.52 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 120.724 -1.235 . . . . 0.0 109.803 179.714 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.459 ' HA ' ' OG1' ' A' ' 54' ' ' THR . 4.1 t0 -54.64 -38.97 67.52 Favored 'General case' 0 N--CA 1.512 2.658 0 O-C-N 121.18 -0.95 . . . . 0.0 110.552 -179.833 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.93 -36.69 82.12 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 179.975 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 56.0 m -91.4 -42.73 10.16 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.026 -1.046 . . . . 0.0 110.379 179.916 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.459 ' OG1' ' HA ' ' A' ' 51' ' ' ASP . 41.8 p -59.94 -40.16 88.02 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 121.104 -0.998 . . . . 0.0 109.994 179.999 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.57 -37.39 78.34 Favored 'General case' 0 N--CA 1.509 2.52 0 O-C-N 121.147 -0.971 . . . . 0.0 110.245 179.783 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.81 -32.64 65.68 Favored 'General case' 0 N--CA 1.508 2.44 0 O-C-N 121.136 -0.978 . . . . 0.0 110.76 179.867 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -88.85 -39.23 13.99 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.948 -1.095 . . . . 0.0 110.413 -179.998 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -66.18 -46.32 77.78 Favored 'General case' 0 N--CA 1.508 2.446 0 O-C-N 121.151 -0.968 . . . . 0.0 109.963 179.923 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -142.72 77.71 1.58 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.269 -0.895 . . . . 0.0 110.19 179.922 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -65.48 -60.19 6.93 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.908 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt . . . . . 0 N--CA 1.494 1.734 0 O-C-N 121.219 -1.165 . . . . 0.0 110.235 -179.965 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A 1062 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_